CAS
939758-07-3 Purity
96%
939758-07-3 Purity
96%
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trans-Methyl 4-(4-fluorophenyl)pyrrolidine-3-carboxylate
CAS
939758-13-1
Catalog Number
ACM939758131
Category
Other Products
Molecular Weight
223.243463 [g/mol]
Molecular Formula
C12H14FNO2
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Specification
Synonyms
Trans-methyl 4-(4-fluorophenyl)pyrrolidine-3-carboxylate, 939758-13-1, MolPort-021-784-411, AKOS015898225, AB19690, AK-42263, KB-144484, FT-0084126, FT-0657352, ST51051366, W9643, I11-0206, trans-methyl-4-(4-fluorophenyl)pyrrolidine-3-carboxylate, METHYL (+/-)-TRANS-4-(4-FLUORO-PHENYL)-PYRROLIDINE-3-CARBOXYLATE, TRANS-4-(4-FLUORO-PHENYL)-PYRROLIDINE-3-CARBOXYLIC ACID METHYL ESTER
IUPAC Name
methyl (3R,4S)-4-(4-fluorophenyl)pyrrolidine-3-carboxylate
InChI Key
REBCUOWHHZXWGJ-MNOVXSKESA-N
Exact Mass
223.10100
H-Bond Acceptor
4
H-Bond Donor
1
What is the molecular formula of trans-Methyl 4-(4-fluorophenyl)pyrrolidine-3-carboxylate?
The molecular formula is C12H14FNO2.
When was trans-Methyl 4-(4-fluorophenyl)pyrrolidine-3-carboxylate created in PubChem?
It was created on March 23, 2010.
What is the molecular weight of trans-Methyl 4-(4-fluorophenyl)pyrrolidine-3-carboxylate?
The molecular weight is 223.24 g/mol.
What is the IUPAC name of trans-Methyl 4-(4-fluorophenyl)pyrrolidine-3-carboxylate?
The IUPAC name is methyl (3R,4S)-4-(4-fluorophenyl)pyrrolidine-3-carboxylate.
What is the InChIKey of trans-Methyl 4-(4-fluorophenyl)pyrrolidine-3-carboxylate?
The InChIKey is REBCUOWHHZXWGJ-MNOVXSKESA-N.
How many hydrogen bond acceptor counts does trans-Methyl 4-(4-fluorophenyl)pyrrolidine-3-carboxylate have?
It has 4 hydrogen bond acceptor counts.
What is the XLogP3-AA value of trans-Methyl 4-(4-fluorophenyl)pyrrolidine-3-carboxylate?
The XLogP3-AA value is 1.3.
How many rotatable bond counts does trans-Methyl 4-(4-fluorophenyl)pyrrolidine-3-carboxylate have?
It has 3 rotatable bond counts.
What is the exact mass of trans-Methyl 4-(4-fluorophenyl)pyrrolidine-3-carboxylate?
The exact mass is 223.10085685 g/mol.
Is trans-Methyl 4-(4-fluorophenyl)pyrrolidine-3-carboxylate a canonicalized compound?
Yes, it is a canonicalized compound according to PubChem.
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