CAS
94346-39-1 Purity
96%
94346-39-1 Purity
96%
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Benzenepropanoic acid, a-chloro-, (aR)-
CAS
94347-44-1
Catalog Number
ACM94347441
Category
Other Products
Molecular Weight
184.62
Molecular Formula
C9H9 Cl O2
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Specification
Synonyms
(R)-2-CHLORO-3-PHENYLPROPANOIC ACID;(R)-(-)-2-CHLORO 3-PHENYLPROPIONIC ACID
IUPAC Name
(2R)-2-chloro-3-phenylpropanoic acid
Canonical SMILES
C1=CC=C(C=C1)CC(C(=O)O)Cl
InChI Key
LIDRHDRWTSPELB-MRVPVSSYSA-N
Exact Mass
184.02900
H-Bond Acceptor
2
H-Bond Donor
1
What is the molecular formula of Benzenepropanoic acid, a-chloro-, (aR)-?
The molecular formula is C9H9ClO2.
What is the molecular weight of Benzenepropanoic acid, a-chloro-, (aR)-?
The molecular weight is 184.62 g/mol.
What is the IUPAC name of Benzenepropanoic acid, a-chloro-, (aR)-?
The IUPAC name is (2R)-2-chloro-3-phenylpropanoic acid.
What is the InChI of Benzenepropanoic acid, a-chloro-, (aR)-?
The InChI is InChI=1S/C9H9ClO2/c10-8(9(11)12)6-7-4-2-1-3-5-7/h1-5,8H,6H2,(H,11,12)/t8-/m1/s1.
What is the InChIKey of Benzenepropanoic acid, a-chloro-, (aR)-?
The InChIKey is LIDRHDRWTSPELB-MRVPVSSYSA-N.
How many hydrogen bond donor counts does Benzenepropanoic acid, a-chloro-, (aR)- have?
It has 1 hydrogen bond donor count.
How many hydrogen bond acceptor counts does Benzenepropanoic acid, a-chloro-, (aR)- have?
It has 2 hydrogen bond acceptor counts.
What is the topological polar surface area of Benzenepropanoic acid, a-chloro-, (aR)-?
The topological polar surface area is 37.3 Å2.
Does Benzenepropanoic acid, a-chloro-, (aR)- have any defined atom stereocenter count?
Yes, it has 1 defined atom stereocenter count.
How many rotatable bond counts does Benzenepropanoic acid, a-chloro-, (aR)- have?
It has 3 rotatable bond counts.
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