AG00DG6G

436091-59-7 | 4-Bromo-7-methoxy-1H-indole

AG00DG6G

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CAS Number	436091-59-7
Catalog Number	AG00DG6G(AGN-PC-07YK8M)
Chemical Name	4-Bromo-7-methoxy-1H-indole
IUPAC Name	4-bromo-7-methoxy-1H-indole
InChI	InChI=1S/C9H8BrNO/c1-12-8-3-2-7(10)6-4-5-11-9(6)8/h2-5,11H,1H3
InChI Key	WCEJDYPAEFIBCD-UHFFFAOYSA-N
MDL Number	MFCD08272257
Molecular Formula	C9H8BrNO
Molecular Weight	226.0699
SMILES	BrC1=C2C=CNC2=C(C=C1)OC
Synonyms	4-bromo-7-methoxy-1H-indole, 436091-59-7, 1h-indole, 4-bromo-7-methoxy-, 4-Bromo-7-methoxyindole, 4-bromo-7-methoxy indole, SCHEMBL594174, CTK4I7549, DTXSID10676457, WCEJDYPAEFIBCD-UHFFFAOYSA-N, BCP26752, KS-000004TS, ANW-53773, MFCD08272257, ZINC44185172, AKOS015898580, CB-3723, CS-W022118, FS-3590, MP-0662, PB12522, AK-51000, CJ-20437, SC-27672, AB0059392, AJ-109516, TC-062926, 4CH-010697, AM20040473, FT-0761577, ST24023404, Z4755, A15570, I10-0519, C9H8BrNO,

Complexity	165
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	224.979g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	226.073g/mol
Monoisotopic Mass	224.979g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	25A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.7

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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