AG00C246

21865-50-9 | 6-Bromo-2,3,4,9-tetrahydro-1H-carbazole

AG00C246

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CAS Number	21865-50-9
Catalog Number	AG00C246(AGN-PC-0JO1DJ)
Chemical Name	6-Bromo-2,3,4,9-tetrahydro-1H-carbazole
IUPAC Name	6-bromo-2,3,4,9-tetrahydro-1H-carbazole
InChI	InChI=1S/C12H12BrN/c13-8-5-6-12-10(7-8)9-3-1-2-4-11(9)14-12/h5-7,14H,1-4H2
InChI Key	SGYJGCFMAGWFCF-UHFFFAOYSA-N
MDL Number	MFCD00094989
Molecular Formula	C12H12BrN
Molecular Weight	250.1344
NSC Number	109356
SMILES	BrC1=CC2=C(NC3=C2CCCC3)C=C1
Synonyms	6-bromo-2,3,4,9-tetrahydro-1H-carbazole, 21865-50-9, 3-bromo-6,7,8,9-tetrahydro-5H-carbazole, 6-bromo-1,2,3,4-tetrahydro-9H-carbazole, 1H-Carbazole, 6-bromo-2,3,4,9-tetrahydro-, NSC109356, AC1L6L7L, AC1Q258W, AC1Q277S, SCHEMBL1053506, KS-00000IKG, ZINC61876, DTXSID20296443, SGYJGCFMAGWFCF-UHFFFAOYSA-N, ALBB-005416, BCP05448, CCG-15341, MFCD00094989, STK501303, 6-bromo-2,3,4,9-tetrahydrocarbazole, AKOS000295382, AM84775, DS-4335, EBD1025096, MCULE-3466108861, NSC-109356, 6-Brom-1,2,3,4-tetrahydro-carbazol;, 6-bromo-1,2,3,4-tetrahydrocarbazole;, NCGC00342470-01, 6-bromo-1,2,3,4-tetrahydro-carbazole;, AC-26893, AJ-09950, AK109439, ST086635, 3-Bromo-5,6,7,8-tetrahydro-9H-carbazole, TR-010255, 6-bromo-1,2,3,4-tetrahydro-9H-carbazole;, 6-bromo-2,3,4,9-tetrahydro-1H-carbazole;, BB 0237723, FT-0679114, ST24045140, X4098, 6-BROMO-1,2,3,4-TETRAHYDROCARBAZOLE, 3-bromo-5,6,7,8,9-pentahydro-4aH-carbazole, Y-9662, AB01334359-02, SR-01000394071, SR-01000394071-1, I14-26245, Z2469680242, A1036/0048529, 3-bromo-9H-carbazole, C12H12BrN, AR-1H1041, CID268877, ACN-036125, 6-fluoro-2,3,4,9-tetrahydro-1H-carbazole, 1592-95-6, 21988-60-3,

Complexity	218
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	249.015g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	0
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	250.139g/mol
Monoisotopic Mass	249.015g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	15.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	4

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

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