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174004-17-2 | Cyclohexanone, O-2-propyn-1-yloxime
CAS No: 174004-17-2 Catalog No: AG001ZDO MDL No:MFCD01822482
Product Description
Catalog Number:
AG001ZDO
Chemical Name:
Cyclohexanone, O-2-propyn-1-yloxime
CAS Number:
174004-17-2
Molecular Formula:
C9H13NO
Molecular Weight:
151.2056
MDL Number:
MFCD01822482
IUPAC Name:
N-prop-2-ynoxycyclohexanimine
InChI:
InChI=1S/C9H13NO/c1-2-8-11-10-9-6-4-3-5-7-9/h1H,3-8H2
InChI Key:
VYYHRKAYTBPEOC-UHFFFAOYSA-N
SMILES:
C#CCON=C1CCCCC1
Properties
Complexity:
179
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
151.1g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
151.209g/mol
Monoisotopic Mass:
151.1g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
21.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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