CAS
928708-25-2 Purity
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928708-25-2 Purity
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Asischem d29227
CAS
928708-28-5
Catalog Number
ACM928708285
Category
Other Products
Molecular Formula
C17H19NO3
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Specification
Synonyms
ASISCHEM D29227;4-(3-FORMYL-2,5-DIMETHYL-1H-PYRROL-1-YL)-BENZOIC ACID 1-METHYLETHYL ESTER;BENZOIC ACID, 4-(3-FORMYL-2,5-DIMETHYL-1H-PYRROL-1-YL)-, 1-METHYLETHYL ESTER
What is the molecular formula of Asischem d29227?
The molecular formula of Asischem d29227 is C17H19NO3.
When was Asischem d29227 first created?
Asischem d29227 was first created on November 13, 2007.
What is the molecular weight of Asischem d29227?
The molecular weight of Asischem d29227 is 285.34 g/mol.
What is the IUPAC name of Asischem d29227?
The IUPAC name of Asischem d29227 is propan-2-yl 4-(3-formyl-2,5-dimethylpyrrol-1-yl)benzoate.
What is the Canonical SMILES representation of Asischem d29227?
The Canonical SMILES representation of Asischem d29227 is CC1=CC(=C(N1C2=CC=C(C=C2)C(=O)OC(C)C)C)C=O.
How many hydrogen bond donor counts does Asischem d29227 have?
Asischem d29227 has 0 hydrogen bond donor counts.
What is the XLogP3-AA value of Asischem d29227?
The XLogP3-AA value of Asischem d29227 is 3.2.
What is the topological polar surface area of Asischem d29227?
The topological polar surface area of Asischem d29227 is 48.3 Ų.
Does Asischem d29227 have any defined atom stereocenters?
No, Asischem d29227 does not have any defined atom stereocenters.
Is Asischem d29227 a canonicalized compound?
Yes, Asischem d29227 is a canonicalized compound.
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