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201139-68-6 | 2-Cyclopentene-1-thione
CAS No: 201139-68-6 Catalog No: AG002D7H MDL No:MFCD09999646
Product Description
Catalog Number:
AG002D7H
Chemical Name:
2-Cyclopentene-1-thione
CAS Number:
201139-68-6
Molecular Formula:
C5H6S
Molecular Weight:
98.1661
MDL Number:
MFCD09999646
IUPAC Name:
cyclopent-2-ene-1-thione
InChI:
InChI=1S/C5H6S/c6-5-3-1-2-4-5/h1,3H,2,4H2
InChI Key:
VWGKGYWOHZQITB-UHFFFAOYSA-N
SMILES:
C1CC=CC1=S
Properties
Complexity:
92.1
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
98.019g/mol
Formal Charge:
0
Heavy Atom Count:
6
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
98.163g/mol
Monoisotopic Mass:
98.019g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
32.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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