DICL_CP_0307398 - DICL Database

Basic Molecular Information

Basic Information

DICL ID

DICL_CP_0307398

PubChem CID

6212

Molecular Formula

CHCl₃

Molecular Weight

119.378 g/mol

Synonyms/Alias

[CHLOROFORM; Trichloromethane; 67-66-3; Trichlormethan; Formyl trichloride; Trichloroform; Methane; trichloro-; Methenyl trichloride; Chloroforme; Methyl trichloride; Methane trichloride; CHCl3; R 20 ...[CHLOROFORM; Trichloromethane; 67-66-3; Trichlormethan; Formyl trichloride; Trichloroform; Methane; trichloro-; Methenyl trichloride; Chloroforme; Methyl trichloride; Methane trichloride; CHCl3; R 20 (Refrigerant); Triclorometano; Cloroformio; Trichloormethaan; Freon 20; 1;1;1-Trichloromethane; Methenyl chloride; RCRA waste number U044; NCI-C02686; Chloroformum; Caswell No. 192; Chloroform bp; Methylidyne trichloride; HSDB 56; Refrigerant R20; CCRIS 137; NSC 77361; trichloro-methane; Hcc 20; R 20; EINECS 200-663-8; NSC-77361; EPA Pesticide Chemical Code 020701; UNII-7V31YC746X; BRN 1731042; DTXSID1020306; CHEBI:35255; AI3-24207; 7V31YC746X; Chloroform [UN1888] [Poison]; chloroformium pro narcosi; DTXCID10306; EC 200-663-8; 4-01-00-00042 (Beilstein Handbook Reference); NSC77361; NCGC00090794-01; chloroform CHCl3; CHLOROFORM (II); CHLOROFORM [II]; CHLOROFORM (IARC); CHLOROFORM [IARC]; CHLOROFORM (MART.); CHLOROFORM [MART.]; CHLOROFORM (USP-RS); CHLOROFORM [USP-RS]; Chloroform; analytical standard; Chloroforme [French]; Cloroformio [Italian]; Trichlormethan [Czech]; Chloroform [NF XVII]; Trichloormethaan [Dutch]; Triclorometano [Italian]; MFCD00000826; CAS-67-66-3; Chloroform [NF]; Chloroform (Stabilized with ~1% Ethanol); CHLOROBUTANOL IMPURITY A (EP IMPURITY); CHLOROBUTANOL IMPURITY A [EP IMPURITY]; CHLOROFORM; ACS; CHLOROFORMWith Amylene; CHLOROFORMWith Ethanol; UN1888; Chloroform (Anhydrous) Contains Amylenes as stabilizer; RCRA waste no. U044; chlorform; chloroforrn; cloroform; trichlormethane; chloro form; chloro-form; Chloroform-; Chloroform; for HPLC; >=99.8%; contains 0.5-1.0% ethanol as stabilizer; trichloro- methane; methane trichloride; tris(chloranyl)methane; CCl3H; HCCl3; Chloroform; for HPLC; Trichloromethane; 9CI; CHLOROFORM [MI]; Chloroform; ethanol-free; Chloroform; HPLC Grade; Trichlormethan/Chloroform; WLN: GYGG; CHLOROFORM [HSDB]; CHLOROFORM [VANDF]; CHLOROFORMUM [HPUS]; R 20(REFRIGERANT); CHLOROFORM [WHO-DD]; Pesticide Code: 020701; CHEMBL44618; Chloroform; p.a.; 99.8%; GTPL2503; NCI-CO2686; CHLOROFORM [GREEN BOOK]; DTXSID10953654; R 20 (VAN); Chloroform with Amylene HPLC grade; Chloroform; Spectrophotometric Grade; Chloroform (stabilized with ethanol); Tox21_111024; Tox21_202494; Chloroform; for HPLC; >=99.5%; Chloroform; for HPLC; >=99.8%; AKOS000269026; Chloroform 100 microg/mL in Methanol; DB11387; InChI=1/CHCl3/c2-1(3)4/h1; UN 1888; Chloroform 5000 microg/mL in Methanol; Chloroform; purification grade; >=99%; NCGC00090794-02; NCGC00260043-01; F 20; R-20; Trichloromethane 10 microg/mL in Methanol; Chloroform; JIS special grade; >=99.0%; Trichloromethane 100 microg/mL in Methanol; C0819; NS00007346; Trichloromethane 5000 microg/mL in Methanol; Chloroform; HPLC grade stabilized with ethanol; Chloroform (stabilized with 2-Methyl-2-butene); Chloroform; SAJ super special grade; >=99.0%; A835850; L023971; Q172275; BRD-K88785477-001-01-8; Chloroform; for HPLC; >=99.8%; amylene stabilized; Chloroform; 99.8%; ACS Reagent stabilized with Ethanol; Chloroform; technical; amylene stabilized; >=99% (GC); F0001-1775; Chloroform; technical grade; 95%; contains 50 ppm Amylene; Chloroform; anhydrous; contains amylenes as stabilizer; >=99%; Chloroform; for HPLC; >=99.8% (chloroform + ethanol; GC); Chloroform stabilized with 50-200 ppm Amylene ACS Reagent Grade; Chloroform; >=99%; PCR Reagent; contains amylenes as stabilizer; Chloroform; ACS reagent; >=99.8%; contains amylenes as stabilizer; Chloroform; AR; contains 1-2% ethanol as stabilizer; >=99.5%; Chloroform; AR; contains 100 ppm amylene as stabilizer; >=99.5%; Chloroform; contains 100-200 ppm amylenes as stabilizer; >=99.5%; Chloroform; contains amylenes as stabilizer; ACS reagent; >=99.8%; Chloroform; contains ethanol as stabilizer; ACS reagent; >=99.8%; Chloroform; LR; contains 100 ppm amylene as stabilizer; >=99%; Chloroform; p.a.; ACS reagent; 99.8%; contains 0.005% Amylene; Chloroform; SAJ first grade; >=99.0%; contains 0.4-0.8% ethanol; Chloroform; UV HPLC spectroscopic; 99.9%; contains 50 ppm Amylene; Chloroform; ACS reagent; Reag. Ph. Eur.; contains ethanol as stabilizer; Chloroform; anhydrous; >=99%; contains 0.5-1.0% ethanol as stabilizer; Chloroform; Pharmaceutical Secondary Standard; Certified Reference Material; Chloroform; puriss. p.a.; reag. ISO; reag. Ph. Eur.; 99.0-99.4% (GC); Chloroform; UV HPLC spectroscopic; 99.0%; contains 0.6-1.0% Ethanol; Chloroform; ACS reagent; >=99.8%; contains 0.5-1.0% ethanol as stabilizer; Chloroform; ACS spectrophotometric grade; >=99.8%; contains amylenes as stabilizer; Chloroform; biotech. grade; >=99.8%; contains 0.5-1.0% ethanol as stabilizer; Chloroform; p.a.; ACS reagent; reag. ISO; 99.8%; contains 50 ppm Amylene; Chloroform; puriss. p.a.; ACS reagent; >=99.8% (chloroform + ethanol; GC); Chloroform; ReagentPlus(R); >=99.8%; contains 0.5-1.0% ethanol as stabilizer; Residual Solvent Class 2 - Chloroform; United States Pharmacopeia (USP) Reference Standard; Chloroform; ACS spectrophotometric grade; >=99.8%; contains 0.5-1.0% ethanol as stabilizer; Chloroform; contains ethanol as stabilizer; meets analytical specification of DAB9; BP; 99-99.4% (GC); Residual Solvent - Chloroform; Pharmaceutical Secondary Standard; Certified Reference Material]

InChI Key

HEDRZPFGACZZDS-UHFFFAOYSA-N

InChI

InChI=1S/CHCl3/c2-1(3)4/h1H

IUPAC Name

chloroform

CAS Number

59495-75-9

Structure Information

Chemical Structure Visualization

SMILES Notation

2D Molecular Drawing

Carbon (C)

Hydrogen (H)

Oxygen (O)

Nitrogen (N)

Sulfur (S)

SDF

5 4 0 0 0 0 0 0 0 0999 V2000
0.0010 -0.0046 0.1336 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0529 1.6903 -0.4007 Cl 0 0 0 0 0 0 0 0 0 0 0 0
-1.4295 -0.864...

Download SDF File (479 bytes)

Experimental Data

Activity Data

Target Ion Channel

SUR2A/Kir6.2 (inwardly rectifying calcium-dependent potassium channels)

Uniprot Accession Number

Q14654

Function

Blocker

Species

Homo sapiens (Human)

IC₅₀

IC₅₀: 2450 nM

EC₅₀

N/A (Not available)

K_i

N/A (Not available)

K_d

N/A (Not available)

Inhibition

N/A (Not available)

Experimental Conditions

pH 7.4

Holding Potential

−150 to 60 mV mV

Temperature

Room Temperature

Test Method

Patch-clamping

Test Species

Xenopus laevis oocyte

Binding Information

Binding Site

Not specified

Binding Site Residue

Not specified

Disease Information

Related Disease

Not specified

References

DOI

10.1007/s00210-019-01751-x

URL

N/A (Not available)

PMID

31720798

Patent

N/A (Not available)

Computed Properties

Heavy Atom Count

Rotatable Bonds

logP

1.9864

Complexity

21.347

TPSA (Å²)

H-Bond Donors

H-Bond Acceptors

Ring Count

New Search

Molecular Details

Basic Molecular Information

Basic Information

Structure Information

Chemical Structure Visualization

Experimental Data

Activity Data

Experimental Conditions

Binding Information

Disease Information

References

Computed Properties