200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 19995-15-4
19995-15-4 | Propanedioic acid, 2-[2-(3-thienyl)ethyl]-, 1,3-diethyl ester
CAS No: 19995-15-4 Catalog No: AG002CHJ MDL No:
Product Description
Catalog Number:
AG002CHJ
Chemical Name:
Propanedioic acid, 2-[2-(3-thienyl)ethyl]-, 1,3-diethyl ester
CAS Number:
19995-15-4
Molecular Formula:
C13H18O4S
Molecular Weight:
270.3446
IUPAC Name:
diethyl 2-(2-thiophen-3-ylethyl)propanedioate
InChI:
InChI=1S/C13H18O4S/c1-3-16-12(14)11(13(15)17-4-2)6-5-10-7-8-18-9-10/h7-9,11H,3-6H2,1-2H3
InChI Key:
JBEUGMYKUQJWGO-UHFFFAOYSA-N
SMILES:
CCOC(=O)C(C(=O)OCC)CCc1cscc1
Properties
Complexity:
262
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
270.093g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
270.343g/mol
Monoisotopic Mass:
270.093g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
80.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.