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113619-47-9 | Pentanal, 5-(diphenylphosphino)-2-methyl-
CAS No: 113619-47-9 Catalog No: AG000961 MDL No:
Product Description
Catalog Number:
AG000961
Chemical Name:
Pentanal, 5-(diphenylphosphino)-2-methyl-
CAS Number:
113619-47-9
Molecular Formula:
C18H21OP
Molecular Weight:
284.3325
IUPAC Name:
5-diphenylphosphanyl-2-methylpentanal
InChI:
InChI=1S/C18H21OP/c1-16(15-19)9-8-14-20(17-10-4-2-5-11-17)18-12-6-3-7-13-18/h2-7,10-13,15-16H,8-9,14H2,1H3
InChI Key:
VCGWGDWDROWHBK-UHFFFAOYSA-N
SMILES:
O=CC(CCCP(c1ccccc1)c1ccccc1)C
Properties
Complexity:
249
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
284.133g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
284.339g/mol
Monoisotopic Mass:
284.133g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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