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20849-87-0 | Thiophene, 2-(2-propen-1-yl)-
CAS No: 20849-87-0 Catalog No: AG002JQI MDL No:
Product Description
Catalog Number:
AG002JQI
Chemical Name:
Thiophene, 2-(2-propen-1-yl)-
CAS Number:
20849-87-0
Molecular Formula:
C7H8S
Molecular Weight:
124.2034
IUPAC Name:
2-prop-2-enylthiophene
InChI:
InChI=1S/C7H8S/c1-2-4-7-5-3-6-8-7/h2-3,5-6H,1,4H2
InChI Key:
CAJILKYXPOWWBF-UHFFFAOYSA-N
SMILES:
C=CCc1cccs1
Properties
Complexity:
78.5
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
124.035g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
124.201g/mol
Monoisotopic Mass:
124.035g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
28.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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