AG00CMMB

38678-86-3 | 2-broMo-4-ethylbenzenaMine

AG00CMMB

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CAS Number	38678-86-3
Catalog Number	AG00CMMB(AGN-PC-0N7VD9)
Chemical Name	2-broMo-4-ethylbenzenaMine
IUPAC Name	2-bromo-4-ethylaniline
InChI	InChI=1S/C8H10BrN/c1-2-6-3-4-8(10)7(9)5-6/h3-5H,2,10H2,1H3
InChI Key	UNXYMQGCZRBOMI-UHFFFAOYSA-N
MDL Number	MFCD00672953
Molecular Formula	C8H10BrN
Molecular Weight	200.0757
SMILES	BrC1=C(C=CC(=C1)CC)N
Synonyms	2-Bromo-4-ethylaniline, 38678-86-3, 2-broMo-4-ethylbenzenaMine, 2-Bromo-4-ethylphenylamine, SCHEMBL1063295, CTK6D1146, UNXYMQGCZRBOMI-UHFFFAOYSA-N, ZINC2567829, MFCD00672953, AKOS017547755, AS03249, AM806904, AS-55182, 2-bromo-4-ethyl-aniline, 2-Bromo-4-isopropylaniline, CID10631857, 51605-97-1,

Complexity	105
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	199g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	200.079g/mol
Monoisotopic Mass	199g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	26A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	\N
Hazard statements	H302-H315-H319-H335
Packing Group	\N
Precautionary statements	P261-P301+P312-P302+P352-P304+P340-P305+P351+P338
UN Code	\N

Certificate of Analysis

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