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80992-67-2 | 4-Penten-2-ol, 5-(diphenylphosphinyl)-5-methoxy-3-methyl-
CAS No: 80992-67-2 Catalog No: AG005HJ0 MDL No:
Product Description
Catalog Number:
AG005HJ0
Chemical Name:
4-Penten-2-ol, 5-(diphenylphosphinyl)-5-methoxy-3-methyl-
CAS Number:
80992-67-2
Molecular Formula:
C19H23O3P
Molecular Weight:
330.3579
IUPAC Name:
5-diphenylphosphoryl-5-methoxy-3-methylpent-4-en-2-ol
InChI:
InChI=1S/C19H23O3P/c1-15(16(2)20)14-19(22-3)23(21,17-10-6-4-7-11-17)18-12-8-5-9-13-18/h4-16,20H,1-3H3
InChI Key:
JEVXRKLXPZDFSL-UHFFFAOYSA-N
SMILES:
COC(=CC(C(O)C)C)P(=O)(c1ccccc1)c1ccccc1
Properties
Complexity:
412
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
330.138g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
330.364g/mol
Monoisotopic Mass:
330.138g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
1
XLogP3:
3.4
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