AG0002SI

10075-48-6 | 1H-Indole, 5-bromo-3-methyl-

AG0002SI

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CAS Number	10075-48-6
Catalog Number	AG0002SI(AGN-PC-0JNSBX)
Chemical Name	1H-Indole, 5-bromo-3-methyl-
IUPAC Name	5-bromo-3-methyl-1H-indole
InChI	InChI=1S/C9H8BrN/c1-6-5-11-9-3-2-7(10)4-8(6)9/h2-5,11H,1H3
InChI Key	GDQXDVJFMLNXHX-UHFFFAOYSA-N
MDL Number	MFCD04038746
Molecular Formula	C9H8BrN
Molecular Weight	210.0705
NSC Number	79234
SMILES	CC1=CNC2=C1C=C(Br)C=C2
Synonyms	5-bromo-3-methyl-1h-indole, 10075-48-6, 5-Bromo-3-Methylindole, 1H-Indole, 5-bromo-3-methyl-, AK-87674, B-8915, NSC79234, 3-methyl-5-bromoindole, AC1L5QTD, AC1Q25YG, KSC493Q9D, 3-Methyl-5-bromo-1H-indole, SCHEMBL1542423, 5-bromanyl-3-methyl-1H-indole, 5-Bromo-3-methylindole, 97%, CTK3J3891, DTXSID10291942, GDQXDVJFMLNXHX-UHFFFAOYSA-N, BCP26571, ZINC1723987, ZX-AT002376, ANW-45798, MFCD04038746, NSC-79234, OR7820, AKOS015834482, AB17162, CB-3431, CS-W008516, FCH1326622, HCH0024536, PS-8019, QC-9162, RTR-000246, TRA0061163, KS-000005V0, AJ-31056, CJ-06887, SC-73072, AB0034381, AX8102902, DB-058482, TR-000246, FT-0676995, ST24032947, X8526, C-1537, A801976, I10-1111, C9H8BrN, 5-bromo-3-methyl-1H-indazole, AR-1G7431, CID254707, 1091-85-6,

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	3.3

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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