AG00CM5I

34598-50-0 | 5-Bromo-2,3-dihydro-1H-inden-1-ol

AG00CM5I

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CAS Number	34598-50-0
Catalog Number	AG00CM5I(AGN-PC-00MRDD)
Chemical Name	5-Bromo-2,3-dihydro-1H-inden-1-ol
IUPAC Name	5-bromo-2,3-dihydro-1H-inden-1-ol
InChI	InChI=1S/C9H9BrO/c10-7-2-3-8-6(5-7)1-4-9(8)11/h2-3,5,9,11H,1,4H2
InChI Key	DRXIUUZVRAOHBS-UHFFFAOYSA-N
MDL Number	MFCD06808667
Molecular Formula	C9H9BrO
Molecular Weight	213.0712
SMILES	OC1CCC2=C1C=CC(Br)=C2
Synonyms	5-bromo-2,3-dihydro-1H-inden-1-ol, 34598-50-0, 5-Bromo-1-indanol, 5-BROMOINDAN-1-OL, 5-Bromo-indan-1-ol, 1H-Inden-1-ol, 5-bromo-2,3-dihydro-, 5-bromo-1-hydroxyindane, AC1Q7AG6, SCHEMBL227502, AMOT0728, SCHEMBL14437215, CTK8E5179, KS-00001ANO, DTXSID90541957, BUTTPARK 91\15-77, DRXIUUZVRAOHBS-UHFFFAOYSA-N, MFCD06808667, AKOS010301281, AB30452, AS-8625, CB-4123, MCULE-5938916015, NE44343, RL03284, AK129580, AM803742, TL8002579, TX-017168, CS-0035517, EN300-60583, (+/-)-5-Bromo-2,3-dihydro-1H-inden-1-ol, J-516868, Z1250208628, ACN-041064, (R)-5-BROMO-2,3-DIHYDRO-1H-INDEN-1-OL, (S)-5-BROMO-2,3-DIHYDRO-1H-INDEN-1-OL, 1038919-63-9, 1270284-15-5,

Complexity	149
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	211.984g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	213.074g/mol
Monoisotopic Mass	211.984g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	20.2A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	2.2

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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