Structure

Pca 4248

CAS
123875-01-4
Catalog Number
ACM123875014
Category
Other Products
Molecular Weight
361.46
Molecular Formula
C19H23NO4S

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Specification

Synonyms
Pca-4248; PTEMC;
IUPAC Name
3-O-methyl 5-O-(2-phenylsulfanylethyl) 2,4,6-trimethyl-1,4-dihydropyridine-3,5-dicarboxylate
Canonical SMILES
CC1C(=C(NC(=C1C(=O)OCCSC2=CC=CC=C2)C)C)C(=O)OC
InChI Key
DHCNAWNKZMNTIS-UHFFFAOYSA-N
Boiling Point
497.4ºC at 760mmHg
Flash Point
254.6ºC
Density
1.21g/cm³
Exact Mass
361.13500
H-Bond Acceptor
5
H-Bond Donor
1
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