CAS
1711-09-7 Purity
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1711-09-7 Purity
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(S)-2-bromo-3-phenylpropanoic acid
CAS
35016-63-8
Catalog Number
ACM35016638
Category
Bromine Series
Molecular Weight
229.07
Molecular Formula
C9H9BrO2
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What is the molecular formula of (S)-2-bromo-3-phenylpropanoic acid?
The molecular formula is C9H9BrO2.
What is the molecular weight of (S)-2-bromo-3-phenylpropanoic acid?
The molecular weight is 229.07 g/mol.
What is the IUPAC name of (S)-2-bromo-3-phenylpropanoic acid?
The IUPAC name is (2S)-2-bromo-3-phenylpropanoic acid.
What is the InChI of (S)-2-bromo-3-phenylpropanoic acid?
The InChI is InChI=1S/C9H9BrO2/c10-8(9(11)12)6-7-4-2-1-3-5-7/h1-5,8H,6H2,(H,11,12)/t8-/m0/s1.
What is the InChIKey of (S)-2-bromo-3-phenylpropanoic acid?
The InChIKey is WDRSCFNERFONKU-QMMMGPOBSA-N.
What is the canonical SMILES of (S)-2-bromo-3-phenylpropanoic acid?
The canonical SMILES is C1=CC=C(C=C1)CC(C(=O)O)Br.
What is the isomeric SMILES of (S)-2-bromo-3-phenylpropanoic acid?
The isomeric SMILES is C1=CC=C(C=C1)C[C@@H](C(=O)O)Br.
What is the CAS number of (S)-2-bromo-3-phenylpropanoic acid?
The CAS number is 35016-63-8.
What is the XLogP3-AA value of (S)-2-bromo-3-phenylpropanoic acid?
The XLogP3-AA value is 2.6.
Is (S)-2-bromo-3-phenylpropanoic acid a canonicalized compound?
Yes, (S)-2-bromo-3-phenylpropanoic acid is a canonicalized compound according to PubChem.
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