CAS
92-98-8 Purity
96%
92-98-8 Purity
96%
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(1S)-1-(3-Bromo-4-fluorophenyl)ethan-1-ol
CAS
929884-46-8
Catalog Number
ACM929884468
Category
Other Products
Molecular Weight
219.05
Molecular Formula
C8H8BrFO
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Specification
Synonyms
(1R)-1-(3-bromo-4-fluorophenyl)ethanol, (1R)-1-(3-bromo-4-fluorophenyl)ethan-1-ol, AC1Q29BL, CTK5J1709, MolPort-005-313-583, 929884-46-8, ZINC12506518, AG-A-01047, AG-B-73583, EN300-53411
IUPAC Name
(1R)-1-(3-bromo-4-fluorophenyl)ethanol
InChI Key
TWIOVUXOLMANJU-RXMQYKEDSA-N
H-Bond Acceptor
2
H-Bond Donor
1
What is the molecular formula of the compound?
The molecular formula of the compound is C8H8BrFO.
What is the molecular weight of the compound?
The molecular weight of the compound is 219.05 g/mol.
What is the IUPAC name of the compound?
The IUPAC name of the compound is (1S)-1-(3-bromo-4-fluorophenyl)ethanol.
What is the Canonical SMILES of the compound?
The Canonical SMILES of the compound is CC(C1=CC(=C(C=C1)F)Br)O.
How many hydrogen bond donor counts does the compound have?
The compound has 1 hydrogen bond donor count.
How many hydrogen bond acceptor counts does the compound have?
The compound has 2 hydrogen bond acceptor counts.
What is the topological polar surface area of the compound?
The topological polar surface area of the compound is 20.2 Ų.
How many defined atom stereocenter counts does the compound have?
The compound has 1 defined atom stereocenter count.
Is the compound canonicalized?
Yes, the compound is canonicalized.
When was the compound last modified?
The compound was last modified on 2023-12-30.
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