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18231-00-0 | 3-Buten-1-ol, 2-methoxy-
CAS No: 18231-00-0 Catalog No: AG0023M3 MDL No:
Product Description
Catalog Number:
AG0023M3
Chemical Name:
3-Buten-1-ol, 2-methoxy-
CAS Number:
18231-00-0
Molecular Formula:
C5H10O2
Molecular Weight:
102.1317
IUPAC Name:
2-methoxybut-3-en-1-ol
InChI:
InChI=1S/C5H10O2/c1-3-5(4-6)7-2/h3,5-6H,1,4H2,2H3
InChI Key:
CWSWWBPJNKCKBO-UHFFFAOYSA-N
SMILES:
COC(C=C)CO
Properties
Complexity:
52
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
102.068g/mol
Formal Charge:
0
Heavy Atom Count:
7
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
102.133g/mol
Monoisotopic Mass:
102.068g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1
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