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15963-49-2 | 2-Cyclobutene-1-methanol
CAS No: 15963-49-2 Catalog No: AG001R8O MDL No:MFCD30499836
Product Description
Catalog Number:
AG001R8O
Chemical Name:
2-Cyclobutene-1-methanol
CAS Number:
15963-49-2
Molecular Formula:
C5H8O
Molecular Weight:
84.1164
MDL Number:
MFCD30499836
IUPAC Name:
cyclobut-2-en-1-ylmethanol
InChI:
InChI=1S/C5H8O/c6-4-5-2-1-3-5/h1-2,5-6H,3-4H2
InChI Key:
DIKTXMYNZIOFEM-UHFFFAOYSA-N
SMILES:
OCC1CC=C1
Properties
Complexity:
66.3
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
84.058g/mol
Formal Charge:
0
Heavy Atom Count:
6
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
84.118g/mol
Monoisotopic Mass:
84.058g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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