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113379-98-9 | Thiophene, 2,3-dihydro-4,5-dimethyl-
CAS No: 113379-98-9 Catalog No: AG0008DB MDL No:
Product Description
Catalog Number:
AG0008DB
Chemical Name:
Thiophene, 2,3-dihydro-4,5-dimethyl-
CAS Number:
113379-98-9
Molecular Formula:
C6H10S
Molecular Weight:
114.2086
IUPAC Name:
4,5-dimethyl-2,3-dihydrothiophene
InChI:
InChI=1S/C6H10S/c1-5-3-4-7-6(5)2/h3-4H2,1-2H3
InChI Key:
LOUSWZZGWAZRIS-UHFFFAOYSA-N
SMILES:
CC1=C(C)CCS1
Properties
Complexity:
103
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
114.05g/mol
Formal Charge:
0
Heavy Atom Count:
7
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
114.206g/mol
Monoisotopic Mass:
114.05g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
25.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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