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70530-86-8 | Phosphonic acid, (cyclohexylideneethenyl)-, bis(1-methylethyl) ester
CAS No: 70530-86-8 Catalog No: AG005I4T MDL No:
Product Description
Catalog Number:
AG005I4T
Chemical Name:
Phosphonic acid, (cyclohexylideneethenyl)-, bis(1-methylethyl) ester
CAS Number:
70530-86-8
Molecular Formula:
C14H25O3P
Molecular Weight:
272.3203
IUPAC Name:
2-di(propan-2-yloxy)phosphorylethenylidenecyclohexane
InChI:
InChI=1S/C14H25O3P/c1-12(2)16-18(15,17-13(3)4)11-10-14-8-6-5-7-9-14/h11-13H,5-9H2,1-4H3
InChI Key:
APGOXGKENWXSCS-UHFFFAOYSA-N
SMILES:
CC(OP(=O)(C=C=C1CCCCC1)OC(C)C)C
Properties
Complexity:
343
Compound Is Canonicalized:
No
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
272.154g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
272.325g/mol
Monoisotopic Mass:
272.154g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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