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28677-93-2 | 1-Propanol, methoxy-
CAS No: 28677-93-2 Catalog No: AG002W1N MDL No:
Product Description
Catalog Number:
AG002W1N
Chemical Name:
1-Propanol, methoxy-
CAS Number:
28677-93-2
Molecular Formula:
C4H10O2
Molecular Weight:
90.1210
IUPAC Name:
1-methoxypropan-1-ol
InChI:
InChI=1S/C4H10O2/c1-3-4(5)6-2/h4-5H,3H2,1-2H3
InChI Key:
LHENQXAPVKABON-UHFFFAOYSA-N
SMILES:
CCC(OC)O
Properties
Complexity:
28.7
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
90.068g/mol
Formal Charge:
0
Heavy Atom Count:
6
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
90.122g/mol
Monoisotopic Mass:
90.068g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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