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123707-02-8 | 6-Hepten-3-yn-1-ol
CAS No: 123707-02-8 Catalog No: AG000KZY MDL No:MFCD15143651
Product Description
Catalog Number:
AG000KZY
Chemical Name:
6-Hepten-3-yn-1-ol
CAS Number:
123707-02-8
Molecular Formula:
C7H10O
Molecular Weight:
110.1537
MDL Number:
MFCD15143651
IUPAC Name:
hept-6-en-3-yn-1-ol
InChI:
InChI=1S/C7H10O/c1-2-3-4-5-6-7-8/h2,8H,1,3,6-7H2
InChI Key:
VULLDQGGFJMZTD-UHFFFAOYSA-N
SMILES:
OCCC#CCC=C
Properties
Complexity:
113
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
110.073g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
110.156g/mol
Monoisotopic Mass:
110.073g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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