CAS
95310-48-8 Purity
98%
95310-48-8 Purity
98%
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Butanoic acid,4-bromo-3-hydroxy-,ethyl ester,(3R)-
CAS
95310-94-4
Catalog Number
ACM95310944
Category
Other Products
Molecular Weight
211.05
Molecular Formula
C6H11BrO3
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Specification
Synonyms
Ethyl (R)-(+)-4-bromo-3-hydroxybutyrate, Ethyl-(R)-(+)-Bromo-3-hydroxybutanoate, 95310-94-4, 95310-48-8, 542911_ALDRICH, CTK5H7641, ZINC02581350, AKOS015915476, AG-H-92515, AG-L-65548, AC-13920, ETHYL (R)-4-BROMO-3-HYDROXYBUTANOATE, I14-54480
IUPAC Name
ethyl (3R)-4-bromo-3-hydroxybutanoate
Canonical SMILES
CCOC(=O)CC(CBr)O
InChI Key
AIZRKZQHJNWBEI-RXMQYKEDSA-N
Boiling Point
285.1ºC at 760mmHg
Flash Point
126.2ºC
Density
1.484g/cm³
Exact Mass
209.98900
H-Bond Acceptor
3
H-Bond Donor
1
WGK Germany
3
What is the molecular formula of ethyl 4-bromo-3-hydroxybutanoate?
The molecular formula is C6H11BrO3.
When was ethyl 4-bromo-3-hydroxybutanoate created?
It was created on July 19, 2005.
What is the IUPAC name of ethyl 4-bromo-3-hydroxybutanoate?
The IUPAC name is ethyl (3S)-4-bromo-3-hydroxybutanoate.
What is the InChIKey for ethyl 4-bromo-3-hydroxybutanoate?
The InChIKey is AIZRKZQHJNWBEI-YFKPBYRVSA-N.
How many hydrogen bond donor counts does ethyl 4-bromo-3-hydroxybutanoate have?
It has 1 hydrogen bond donor count.
What is the topological polar surface area of ethyl 4-bromo-3-hydroxybutanoate?
The topological polar surface area is 46.5 ?2.
Is the compound canonicalized according to PubChem?
Yes, the compound is canonicalized.
What is the molecular weight of ethyl 4-bromo-3-hydroxybutanoate?
The molecular weight is 211.05 g/mol.
How many rotatable bond counts does ethyl 4-bromo-3-hydroxybutanoate have?
It has 5 rotatable bond counts.
What is the exact mass of ethyl 4-bromo-3-hydroxybutanoate?
The exact mass is 209.98916 g/mol.
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