AG0025W9

17826-04-9 | 1H-Indole-3-carboxaldehyde, 6-bromo-

AG0025W9

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CAS Number	17826-04-9
Catalog Number	AG0025W9(AGN-PC-0KL757)
Chemical Name	1H-Indole-3-carboxaldehyde, 6-bromo-
IUPAC Name	6-bromo-1H-indole-3-carbaldehyde
InChI	InChI=1S/C9H6BrNO/c10-7-1-2-8-6(5-12)4-11-9(8)3-7/h1-5,11H
InChI Key	WCCLQCBKBPTODV-UHFFFAOYSA-N
MDL Number	MFCD00792689
Molecular Formula	C9H6BrNO
Molecular Weight	224.0540
SMILES	O=CC1=CNC2=C1C=CC(Br)=C2
Synonyms	6-bromoindole-3-carbaldehyde, 6-Bromoindole-3-carboxaldehyde, 17826-04-9, 6-Bromo-1H-indole-3-carbaldehyde, 6-Bromo-3-formylindole, 6-bromoindole-3-carbaldehyde, 6-bromo-1H-indole-3-carboxaldehyde, 1H-Indole-3-carboxaldehyde, 6-bromo-, CHEMBL3358229, MFCD00792689, PubChem7691, AC1MDRZX, ACMC-209ee9, KSC536O3D, AMBZ0429, SCHEMBL1081911, CTK4D6731, WCCLQCBKBPTODV-UHFFFAOYSA-, DTXSID10383452, 6-bromo-1H-indol-3-carbaldehyde, WCCLQCBKBPTODV-UHFFFAOYSA-N, 6-BROMINDOL-3-CARBALDEHYDE, ACN-S002826, KS-00000J0H, ZINC2569373, 6-bromanyl-1H-indole-3-carbaldehyde, ANW-22927, BBL029018, BDBM50037783, GEO-00485, SBB005309, STK934860, 1H-Indole-3-carboxaldehyde,6-bromo-, 6-Bromoindole-3-carboxaldehyde, 97%, AKOS005259128, AB07122, AM86043, AN-5522, CB-1016, MCULE-9822277839, Methyl 7-benzyloxyindole-2-carboxylate, PS-3556, RD-0126, TRA0078899, NCGC00338460-01, AC-18164, AC-24833, AJ-41708, AK-84448, BC003267, BC213338, CJ-09864, SC-01866, AB0009805, AB1010276, DB-026384, TC-010763, 4CH-009663, B2778, FT-0637607, ST24029636, C-1252, AB01331264-02, 826B049, A812351, I10-0156, InChI=1/C9H6BrNO/c10-7-1-2-8-6(5-12)4-11-9(8)3-7/h1-5,11H, 96564-48-6, C9H6BrNO, ZINC02569373, 6-Bromo-1H-indazole-3-carboxaldehyde, ACN-029617, CID2794830, 6-Bromoindole-3-carboxaldehyde, 97% 1g, C2463, B-8610, 6-Bromoindole-3-carboxaldehyde, 98% - 1G 1g, 885271-72-7,

Complexity	185
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	222.963g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	224.057g/mol
Monoisotopic Mass	222.963g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	32.9A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.4

GHS Hazard and Precautionary Statements

Symbol:
Hazard statements	H302-H315-H319-H335
Precuationary statements	P261-P305+P351+P338
Siginal words

Certificate of Analysis

Lot Number