CAS
93985-69-4 Purity
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93985-69-4 Purity
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cis-2-Phenylcyclopropanecarboxylic acid
CAS
939-89-9
Catalog Number
ACM939899
Category
Other Products
Molecular Weight
162.185200 [g/mol]
Molecular Formula
C10H10O2
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Specification
Synonyms
Oprea1_255436, Ambcb5100597, 2-Phenylcyclopropanecarboxylic acid, MolPort-000-163-167, trans-2-Phenylcyclopropanecarboxylic acid, HMS1577M05, CID70323, EINECS 213-366-3, NSC245855, STK346858, cis-1-Phenylcyclopropane-2-carboxylic acid, trans-2-Phenyl-1-cyclopropanecarboxylic acid, AQ-917/40172594, I04-0383, 939-90-2, 5685-38-1, 939-89-9, InChI=1/C10H10O2/c11-10(12)9-6-8(9)7-4-2-1-3-5-7/h1-5,8-9H,6H2,(H,11,12
IUPAC Name
2-phenylcyclopropane-1-carboxylic acid
Canonical SMILES
C1C(C1C(=O)O)C2=CC=CC=C2
InChI Key
AHDDRJBFJBDEPW-UHFFFAOYSA-N
Exact Mass
162.06800
H-Bond Acceptor
2
H-Bond Donor
1
What is the PubChem CID of cis-2-Phenylcyclopropanecarboxylic acid?
PubChem CID 778516
What is the molecular formula of cis-2-Phenylcyclopropanecarboxylic acid?
The molecular formula is C10H10O2.
What is the molecular weight of cis-2-Phenylcyclopropanecarboxylic acid?
The molecular weight is 162.18 g/mol.
What is the IUPAC name of cis-2-Phenylcyclopropanecarboxylic acid?
The IUPAC name is (1R,2S)-2-phenylcyclopropane-1-carboxylic acid.
What is the InChI of cis-2-Phenylcyclopropanecarboxylic acid?
The InChI is InChI=1S/C10H10O2/c11-10(12)9-6-8(9)7-4-2-1-3-5-7/h1-5,8-9H,6H2,(H,11,12)/t8-,9-/m1/s1.
What is the InChIKey of cis-2-Phenylcyclopropanecarboxylic acid?
The InChIKey is AHDDRJBFJBDEPW-RKDXNWHRSA-N.
What is the canonical SMILES of cis-2-Phenylcyclopropanecarboxylic acid?
The canonical SMILES is C1C(C1C(=O)O)C2=CC=CC=C2.
What is the CAS number of cis-2-Phenylcyclopropanecarboxylic acid?
The CAS number is 48126-51-8.
What is the XLogP3-AA value of cis-2-Phenylcyclopropanecarboxylic acid?
The XLogP3-AA value is 1.6.
Is cis-2-Phenylcyclopropanecarboxylic acid a canonicalized compound?
Yes, it is a canonicalized compound.
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