AG002PON

248602-16-6 | 1H-Indole, 6-bromo-5-methyl-

AG002PON

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CAS Number	248602-16-6
Catalog Number	AG002PON(AGN-PC-0N9XZX)
Chemical Name	1H-Indole, 6-bromo-5-methyl-
IUPAC Name	6-bromo-5-methyl-1H-indole
InChI	InChI=1S/C9H8BrN/c1-6-4-7-2-3-11-9(7)5-8(6)10/h2-5,11H,1H3
InChI Key	DZPFAUCRIATHQM-UHFFFAOYSA-N
MDL Number	MFCD09026999
Molecular Formula	C9H8BrN
Molecular Weight	210.0705
SMILES	CC1=CC2=C(NC=C2)C=C1Br
Synonyms	6-bromo-5-methyl-1H-indole, 248602-16-6, 6-Bromo-5-methylindole, AK-31446, 1H-Indole, 6-bromo-5-methyl-, SCHEMBL917519, 5-Methyl-6-bromo-1H-indole, 1H-Indole,6-bromo-5-methyl-, CTK4F4518, DTXSID50444359, DZPFAUCRIATHQM-UHFFFAOYSA-N, BCP04567, KS-000007ZY, ANW-61886, MFCD09026999, ZINC14985799, AKOS016004849, ACN-047800, CB-3990, CS-W003569, FCH1390243, MP-1646, RP26543, SB22958, AJ-66439, CJ-14864, DS-12129, QC-10707, SY027373, AB0051479, AX8108513, DB-067274, ST2412240, TC-150631, 4CH-003695, FT-0758884, Z4495, MFCD09026999 (95+%), J-518411, C9H8BrN, CID10750926,

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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