AG00DIYV

532440-88-3 | 2-Bromo-5-methoxy-4-methylaniline

AG00DIYV

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CAS Number	532440-88-3
Catalog Number	AG00DIYV(AGN-PC-03IF6E)
Chemical Name	2-Bromo-5-methoxy-4-methylaniline
IUPAC Name	2-bromo-5-methoxy-4-methylaniline
InChI	InChI=1S/C8H10BrNO/c1-5-3-6(9)7(10)4-8(5)11-2/h3-4H,10H2,1-2H3
InChI Key	WGVJMLYQPNCPSD-UHFFFAOYSA-N
MDL Number	MFCD11841053
Molecular Formula	C8H10BrNO
Molecular Weight	216.0751
SMILES	NC1=CC(OC)=C(C)C=C1Br
Synonyms	2-bromo-5-methoxy-4-methylaniline, 532440-88-3, AK-71003, bromomethoxymethylaniline, SCHEMBL3343872, CTK6J8378, WGVJMLYQPNCPSD-UHFFFAOYSA-N, KS-00000O8W, 2-bromo-5-methoxy-4-methyl-aniline, MFCD11841053, SBB095204, ZINC29753854, 2-bromo-5-methoxy-4-methylphenylamine, AKOS005073681, FCH1405896, MCULE-7074417605, NC-0740, RP12500, AJ-83789, AX8201956, ST2404233, TR-065348,

Complexity	131
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	214.995g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	216.078g/mol
Monoisotopic Mass	214.995g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	35.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.3

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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