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Home > Other Building Blocks > 920007-10-9
920007-10-9 | 2-Pentenoic acid, 5-(2-thienyl)-
CAS No: 920007-10-9 Catalog No: AG006G6C MDL No:
Product Description
Catalog Number:
AG006G6C
Chemical Name:
2-Pentenoic acid, 5-(2-thienyl)-
CAS Number:
920007-10-9
Molecular Formula:
C9H10O2S
Molecular Weight:
182.2395
IUPAC Name:
5-thiophen-2-ylpent-2-enoic acid
InChI:
InChI=1S/C9H10O2S/c10-9(11)6-2-1-4-8-5-3-7-12-8/h2-3,5-7H,1,4H2,(H,10,11)
InChI Key:
WHNZVCYJWWASJC-UHFFFAOYSA-N
SMILES:
OC(=O)C=CCCc1cccs1
Properties
Complexity:
177
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
182.04g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
182.237g/mol
Monoisotopic Mass:
182.04g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
65.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
2.2
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