AG003KYG

475039-81-7 | 4-Bromo-3-methyl-1H-indole

AG003KYG

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CAS Number	475039-81-7
Catalog Number	AG003KYG(AGN-PC-09MQRP)
Chemical Name	4-Bromo-3-methyl-1H-indole
IUPAC Name	4-bromo-3-methyl-1H-indole
InChI	InChI=1S/C9H8BrN/c1-6-5-11-8-4-2-3-7(10)9(6)8/h2-5,11H,1H3
InChI Key	HQYNWUZMWCHKGJ-UHFFFAOYSA-N
MDL Number	MFCD15144591
Molecular Formula	C9H8BrN
Molecular Weight	210.0705
SMILES	BrC1=C2C(=CNC2=CC=C1)C
Synonyms	4-bromo-3-methyl-1H-indole, 475039-81-7, 4-Bromo-3-methylindole, 4-Bromo-3-methyl-indole, AK-86948, 3-methyl-4-bromoindole, SCHEMBL3614670, CTK8B7485, DTXSID60680943, HQYNWUZMWCHKGJ-UHFFFAOYSA-N, KS-000005UZ, ZX-AT002361, ANW-57461, MFCD15144591, ZINC72194624, AKOS015951480, 1H-INDOLE,4-BROMO-3-METHYL-, CB-3794, DS-2198, FCH1388539, MP-1516, OR61433, QC-3965, RP26544, SB14935, TRA0027018, 1H-INDOLE, 4-BROMO-3-METHYL-, CJ-21673, DA-19316, SC-13006, SY031146, AB0053511, AB1010329, AJ-119710, AX8160071, TC-146206, 4CH-008508, AM20040533, FT-0717878, ST24028961, Z4780, MFCD15144591 (95%), J-514741, C9H8BrN, ACN-045592,

Complexity	149
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	208.984g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	0
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	210.074g/mol
Monoisotopic Mass	208.984g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	15.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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