AG002NY2

2362-62-1 | Benzenecarbothioamide, 4-methyl-

AG002NY2

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CAS Number	2362-62-1
Catalog Number	AG002NY2(AGN-PC-0JVOQA)
Chemical Name	Benzenecarbothioamide, 4-methyl-
IUPAC Name	4-methylbenzenecarbothioamide
InChI	InChI=1S/C8H9NS/c1-6-2-4-7(5-3-6)8(9)10/h2-5H,1H3,(H2,9,10)
InChI Key	QXYZSNGZMDVLKN-UHFFFAOYSA-N
MDL Number	MFCD00173750
Molecular Formula	C8H9NS
Molecular Weight	151.2288
SMILES	S=C(N)C1=CC=C(C)C=C1
Synonyms	4-methylthiobenzamide, 4-PMTB, 2362-62-1, 4-methylbenzothioamide, 4-methyl(thiobenzamide), 4-Methylthiobenzamide, 4-Methylbenzenecarbothioamide, 4-Methylbenzenethioamide, 4-methylbenzene-1-carbothioamide, Benzenecarbothioamide, 4-methyl-, 4-Methyl-thiobenzamide, QXYZSNGZMDVLKN-UHFFFAOYSA-N, MFCD00173750, amino(4-methylphenyl)methane-1-thione, 4-Pmtb, p-Methylthiobenzoylamide, p-Toluthioamide, p-Methylthiobenzamide, ACMC-20ameg, AC1LEJUD, AC1Q7EFE, 4-methylbenzene carbothioamide, KSC497I8H, SCHEMBL202776, 4-Methylbenzenecarbothioamide #, 4-Methylbenzenethioamide, 96%, Benzenecarbothioamide,4-methyl-, CHEMBL285350, CTK3J7483, DTXSID20178295, KS-00000ZU2, STR03083, ZINC6070792, 1615AB, CM-583, FC0675, SBB016502, STK437019, AKOS000200491, AB04365, FS-1641, MCULE-5240518369, NE25915, RTR-010955, VZ29360, AJ-55633, CJ-12876, ST2418485, TR-010955, FT-0619060, ST45024103, I01-7701, Z56939152, C8H9NS, C8-H9-N-S, AR-1G3568, CID737209, 23771-22-4,

Complexity	125
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	151.046g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	151.227g/mol
Monoisotopic Mass	151.046g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	58.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H319
Packing Group
Precautionary statements	P305+P351+P338
UN Code	\N

Certificate of Analysis

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