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16169-19-0 | 2-Propanol, 1-methoxy-3-(2-propyn-1-yloxy)-
CAS No: 16169-19-0 Catalog No: AG001VSW MDL No:
Product Description
Catalog Number:
AG001VSW
Chemical Name:
2-Propanol, 1-methoxy-3-(2-propyn-1-yloxy)-
CAS Number:
16169-19-0
Molecular Formula:
C7H12O3
Molecular Weight:
144.1684
IUPAC Name:
1-methoxy-3-prop-2-ynoxypropan-2-ol
InChI:
InChI=1S/C7H12O3/c1-3-4-10-6-7(8)5-9-2/h1,7-8H,4-6H2,2H3
InChI Key:
ROCPGFWZWGEGLB-UHFFFAOYSA-N
SMILES:
COCC(COCC#C)O
Properties
Complexity:
113
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
144.079g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
144.17g/mol
Monoisotopic Mass:
144.079g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
38.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.6
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