CAS
939757-45-6 Purity
96%
939757-45-6 Purity
96%
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trans-1-Benzyl-4-(3-methoxyphenyl)pyrrolidine-3-carboxylic acid
CAS
939757-61-6
Catalog Number
ACM939757616
Category
Other Products
Molecular Weight
311.37
Molecular Formula
C19H21NO3
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Specification
Synonyms
Trans-1-benzyl-4-(3-methoxyphenyl)pyrrolidine-3-carboxylic acid, 939757-61-6, CTK5H4334, AG-L-60513, KB-145729
IUPAC Name
(3S,4R)-1-benzyl-4-(3-methoxyphenyl)pyrrolidine-3-carboxylic acid
InChI Key
ZFHOJYCXBWSOAW-ZWKOTPCHSA-N
Exact Mass
311.15200
H-Bond Acceptor
4
H-Bond Donor
1
What is the molecular formula of trans-1-Benzyl-4-(3-methoxyphenyl)pyrrolidine-3-carboxylic acid?
The molecular formula is C19H21NO3.
When was trans-1-Benzyl-4-(3-methoxyphenyl)pyrrolidine-3-carboxylic acid created and modified?
It was created on 2010-03-23 and last modified on 2023-12-30.
What is the IUPAC name of trans-1-Benzyl-4-(3-methoxyphenyl)pyrrolidine-3-carboxylic acid?
The IUPAC name is (3R,4S)-1-benzyl-4-(3-methoxyphenyl)pyrrolidine-3-carboxylic acid.
What is the InChIKey of trans-1-Benzyl-4-(3-methoxyphenyl)pyrrolidine-3-carboxylic acid?
The InChIKey is ZFHOJYCXBWSOAW-MSOLQXFVSA-N.
How many hydrogen bond donor counts does trans-1-Benzyl-4-(3-methoxyphenyl)pyrrolidine-3-carboxylic acid have?
It has 1 hydrogen bond donor count.
What is the topological polar surface area of trans-1-Benzyl-4-(3-methoxyphenyl)pyrrolidine-3-carboxylic acid?
The topological polar surface area is 49.8 Ų.
Is the compound canonicalized according to PubChem?
Yes, the compound is canonicalized.
What is the molecular weight of trans-1-Benzyl-4-(3-methoxyphenyl)pyrrolidine-3-carboxylic acid?
The molecular weight is 311.4 g/mol.
How many defined atom stereocenter counts does trans-1-Benzyl-4-(3-methoxyphenyl)pyrrolidine-3-carboxylic acid have?
It has 2 defined atom stereocenter counts.
What is the XLogP3-AA value of trans-1-Benzyl-4-(3-methoxyphenyl)pyrrolidine-3-carboxylic acid?
The XLogP3-AA value is 0.5.
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