(1R,2R)-2-bromo-2,3-dihydro-1H-inden-1-ol

HCID 820607

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Basic information

CAS: 79465-06-8
Standard SMILES: O[C@@H]1c2ccccc2C[C@H]1Br
InChIKey: RTESDSDXFLYAKZ-RKDXNWHRSA-N
Molecular formula: C9H9BrO
Average molar mass: 213.07 g/mol

Overview

See also: (1S,2S)-2-Bromo-2,3-dihydro-1H-inden-1-ol (annotation moved to).

Names & identifiers

Preferred name: (1R,2R)-2-bromo-2,3-dihydro-1H-inden-1-ol
IUPAC: (1R,2R)-2-bromo-2,3-dihydro-1H-inden-1-ol

Names & synonyms

(1R,2R)-2-bromo-2,3-dihydro-1H-inden-1-ol79465-06-8RefChem:393189984-070-610368-44-2trans-2-Bromo-2,3-dihydro-1H-inden-1-oltrans-2-Bromo-1-indanolMFCD00151318(1r,2r)-2-bromoindan-1-ol1H-Inden-1-ol, 2-bromo-2,3-dihydro-, (1R,2R)-rel-trans-2-Bromo-1-hydroxyindanetrans-2-bromoindan-1-ol

Show more names

(trans)-2-bromo-1-indanolSCHEMBL1645321trans-(+)-2-bromo-1-indanoltrans-(-)-2-bromo-1-indanolRTESDSDXFLYAKZ-RKDXNWHRSA-Ntrans-(+/-)-2-bromoindan-1-ol(+/-) trans-2-bromo-1-hydroxyindanAKOS015900269

Database identifiers

CAS: 79465-06-8
PubChem CID: 820607
EC Number: 984-070-6
Nikkaji: J732.262C

Properties

Computed structural properties

XLogP: 1.9
Topological polar surface area: 20.2 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 1
Rotatable bonds: 0
Heavy atoms: 11
Formal charge: 0
Complexity: 148

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.