AG00CKW3

36155-85-8 | 5-Chlorothiophene-3-carbaldehyde

AG00CKW3

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CAS Number	36155-85-8
Catalog Number	AG00CKW3(AGN-PC-0NID8P)
Chemical Name	5-Chlorothiophene-3-carbaldehyde
IUPAC Name	5-chlorothiophene-3-carbaldehyde
InChI	InChI=1S/C5H3ClOS/c6-5-1-4(2-7)3-8-5/h1-3H
InChI Key	BGOGYRKWKJGOHZ-UHFFFAOYSA-N
MDL Number	MFCD17016115
Molecular Formula	C5H3ClOS
Molecular Weight	146.5947
SMILES	O=CC1=CSC(Cl)=C1
Synonyms	5-Chlorothiophene-3-carbaldehyde, 36155-85-8, 5-CHLOROTHIOPHENE-3-CARBOXALDEHYDE, 3-Thiophenecarboxaldehyde, 5-chloro-, 5-Chlorothiophene-3-carbo..., SCHEMBL1503787, CTK1B6471, DTXSID60484387, 5-chloro-thiophene-3-carbaldehyde, BGOGYRKWKJGOHZ-UHFFFAOYSA-N, 2-chloro-4-thiophenecarboxaldehyde, KS-000003VW, MFCD17016115, RW2810, ZINC39201272, AKOS016011107, CS-W006694, PB18241, QC-2053, 2-CHLOROTHIOPHENE-4-CARBOXALDEHYDE, 5-CHLORO-3-THIOPHENECARBOXALDEHYDE, AJ-98998, AK-50469, CJ-19838, DS-15440, AB0064382, 4CH-010449, FT-0686478, ST24024064, C-8382,

Complexity	96.4
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	145.959g/mol
Formal Charge	0
Heavy Atom Count	8
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	146.588g/mol
Monoisotopic Mass	145.959g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	45.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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