AG009JUH

1356113-07-9 | 4-Bromo-3-fluoro-5-methylaniline

AG009JUH

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CAS Number	1356113-07-9
Catalog Number	AG009JUH(AGN-PC-0BEP3V)
Chemical Name	4-Bromo-3-fluoro-5-methylaniline
IUPAC Name	4-bromo-3-fluoro-5-methylaniline
InChI	InChI=1S/C7H7BrFN/c1-4-2-5(10)3-6(9)7(4)8/h2-3H,10H2,1H3
InChI Key	WTNCRDVVJCQOOF-UHFFFAOYSA-N
MDL Number	MFCD19686156
Molecular Formula	C7H7BrFN
Molecular Weight	204.0396
SMILES	NC1=CC(C)=C(Br)C(F)=C1
Synonyms	4-Bromo-3-fluoro-5-methylaniline, 1356113-07-9, Benzenamine, 4-bromo-3-fluoro-5-methyl-, SCHEMBL14744248, KS-00000SGV, MFCD19686156, ZINC67802769, AKOS024262554, DS-9372, AK158574, SC-43992, AJ-117059, FT-0742821, ST24043422, Z2327226126, 4-bromo-3-fluoro-5-methylBenzenamine,

Complexity	120
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	202.975g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	204.042g/mol
Monoisotopic Mass	202.975g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	26A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.4

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

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