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80079-24-9 | 1-Propanol, 2-[(2-hydroxyethyl)imino]-
CAS No: 80079-24-9 Catalog No: AG005DCC MDL No:
Product Description
Catalog Number:
AG005DCC
Chemical Name:
1-Propanol, 2-[(2-hydroxyethyl)imino]-
CAS Number:
80079-24-9
Molecular Formula:
C5H11NO2
Molecular Weight:
117.1463
IUPAC Name:
2-(2-hydroxyethylimino)propan-1-ol
InChI:
InChI=1S/C5H11NO2/c1-5(4-8)6-2-3-7/h7-8H,2-4H2,1H3
InChI Key:
MPOLGKWWFPEZRZ-UHFFFAOYSA-N
SMILES:
OCCN=C(CO)C
Properties
Complexity:
80.5
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
117.079g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
117.148g/mol
Monoisotopic Mass:
117.079g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
52.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.3
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