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89222-68-4 | 2-Pentene-1-thiol, (E)-
CAS No: 89222-68-4 Catalog No: AG0043LM MDL No:
Product Description
Catalog Number:
AG0043LM
Chemical Name:
2-Pentene-1-thiol, (E)-
CAS Number:
89222-68-4
Molecular Formula:
C5H10S
Molecular Weight:
102.1979
IUPAC Name:
pent-2-ene-1-thiol
InChI:
InChI=1S/C5H10S/c1-2-3-4-5-6/h3-4,6H,2,5H2,1H3
InChI Key:
YOTUISMXINCMRE-UHFFFAOYSA-N
SMILES:
CC/C=C/CS
Properties
Complexity:
39.2
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
102.05g/mol
Formal Charge:
0
Heavy Atom Count:
6
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
102.195g/mol
Monoisotopic Mass:
102.05g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
1.8
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