AG001AHJ

13920-91-7 | Benzenamine, 2-(ethylthio)-

AG001AHJ

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CAS Number	13920-91-7
Catalog Number	AG001AHJ(AGN-PC-0MZLOS)
Chemical Name	Benzenamine, 2-(ethylthio)-
IUPAC Name	2-ethylsulfanylaniline
InChI	InChI=1S/C8H11NS/c1-2-10-8-6-4-3-5-7(8)9/h3-6H,2,9H2,1H3
InChI Key	OXFMPJRLJLBBRQ-UHFFFAOYSA-N
MDL Number	MFCD08691983
Molecular Formula	C8H11NS
Molecular Weight	153.2446
SMILES	C1(=CC=CC=C1N)SCC
Synonyms	2-(Ethylthio)aniline, 2-(ethylsulfanyl)aniline, 13920-91-7, 2-aminophenyl ethyl sulphide, 2-ethylsulfanylaniline, 2-ethylthioaniline, AC1Q38EO, Benzenamine, 2-(ethylthio)-, SCHEMBL2857496, CTK4C1678, DTXSID10436139, OXFMPJRLJLBBRQ-UHFFFAOYSA-N, BBL003593, MFCD08691983, STK869043, ZINC16576888, AKOS000195455, MCULE-1907352780, AJ-68933, AK111932, EN300-49598, K-4502, J-007250, Z1217910514, CID10149009,

Complexity	95.3
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	153.061g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	153.243g/mol
Monoisotopic Mass	153.061g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	51.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H312-H332
Packing Group
Precautionary statements	P280
UN Code

Certificate of Analysis

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