CAS
95728-57-7 Purity
96%
95728-57-7 Purity
96%
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Benzyl(2R)-4-oxoazetidine-2-carboxylate
CAS
95729-87-6
Catalog Number
ACM95729876
Category
Other Products
Molecular Weight
205.2099
Molecular Formula
C11H11NO3
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Specification
Synonyms
benzyl (2R)-4-oxoazetidine-2-carboxylate, ZINC00115792, AC1LESHZ, SCHEMBL7263768, AJ-11499, ZB003882, 95729-87-6
IUPAC Name
benzyl (2R)-4-oxoazetidine-2-carboxylate
Canonical SMILES
C1C(NC1=O)C(=O)OCC2=CC=CC=C2
InChI Key
WGLLBHSIXLWVFU-SECBINFHSA-N
Exact Mass
205.07400
H-Bond Acceptor
3
H-Bond Donor
1
What is the molecular formula of Benzyl (2R)-4-oxoazetidine-2-carboxylate?
The molecular formula of Benzyl (2R)-4-oxoazetidine-2-carboxylate is C11H11NO3.
What are the synonyms for Benzyl (2R)-4-oxoazetidine-2-carboxylate?
The synonyms for Benzyl (2R)-4-oxoazetidine-2-carboxylate include 95729-87-6, (R)-Benzyl 4-oxoazetidine-2-carboxylate, and phenylmethyl ester.
What is the molecular weight of Benzyl (2R)-4-oxoazetidine-2-carboxylate?
The molecular weight of Benzyl (2R)-4-oxoazetidine-2-carboxylate is 205.21 g/mol.
When was Benzyl (2R)-4-oxoazetidine-2-carboxylate created and modified in PubChem?
Benzyl (2R)-4-oxoazetidine-2-carboxylate was created on July 8, 2005, and last modified on December 30, 2023.
What is the IUPAC name of Benzyl (2R)-4-oxoazetidine-2-carboxylate?
The IUPAC name of Benzyl (2R)-4-oxoazetidine-2-carboxylate is benzyl (2R)-4-oxoazetidine-2-carboxylate.
What is the InChI of Benzyl (2R)-4-oxoazetidine-2-carboxylate?
The InChI of Benzyl (2R)-4-oxoazetidine-2-carboxylate is InChI=1S/C11H11NO3/c13-10-6-9(12-10)11(14)15-7-8-4-2-1-3-5-8/h1-5,9H,6-7H2,(H,12,13)/t9-/m1/s1.
What is the InChIKey of Benzyl (2R)-4-oxoazetidine-2-carboxylate?
The InChIKey of Benzyl (2R)-4-oxoazetidine-2-carboxylate is WGLLBHSIXLWVFU-SECBINFHSA-N.
What is the canonical SMILES of Benzyl (2R)-4-oxoazetidine-2-carboxylate?
The canonical SMILES of Benzyl (2R)-4-oxoazetidine-2-carboxylate is C1C(NC1=O)C(=O)OCC2=CC=CC=C2.
What is the XLogP3-AA value of Benzyl (2R)-4-oxoazetidine-2-carboxylate?
The XLogP3-AA value of Benzyl (2R)-4-oxoazetidine-2-carboxylate is 0.7.
How many hydrogen bond donor counts and acceptor counts does Benzyl (2R)-4-oxoazetidine-2-carboxylate have?
Benzyl (2R)-4-oxoazetidine-2-carboxylate has 1 hydrogen bond donor count and 3 hydrogen bond acceptor counts.
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