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1194-12-3 | 2-Propyn-1-ol, 3-(2-furanyl)-
CAS No: 1194-12-3 Catalog No: AG000IOY MDL No:MFCD07364010
Product Description
Catalog Number:
AG000IOY
Chemical Name:
2-Propyn-1-ol, 3-(2-furanyl)-
CAS Number:
1194-12-3
Molecular Formula:
C7H6O2
Molecular Weight:
122.1213
MDL Number:
MFCD07364010
IUPAC Name:
3-(furan-2-yl)prop-2-yn-1-ol
InChI:
InChI=1S/C7H6O2/c8-5-1-3-7-4-2-6-9-7/h2,4,6,8H,5H2
InChI Key:
OTFWKDGMVFWJSU-UHFFFAOYSA-N
SMILES:
OCC#Cc1ccco1
Properties
Complexity:
140
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
122.037g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
122.123g/mol
Monoisotopic Mass:
122.037g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
33.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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