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2181-97-7 | (2-Methoxy-2-oxoethyl)triphenylphosphonium chloride
CAS No: 2181-97-7 Catalog No: AG003OPC MDL No:MFCD00050199
Product Description
Catalog Number:
AG003OPC
Chemical Name:
(2-Methoxy-2-oxoethyl)triphenylphosphonium chloride
CAS Number:
2181-97-7
Molecular Formula:
C21H20ClO2P
Molecular Weight:
370.8091
MDL Number:
MFCD00050199
IUPAC Name:
(2-methoxy-2-oxoethyl)-triphenylphosphanium;chloride
InChI:
InChI=1S/C21H20O2P.ClH/c1-23-21(22)17-24(18-11-5-2-6-12-18,19-13-7-3-8-14-19)20-15-9-4-10-16-20;/h2-16H,17H2,1H3;1H/q+1;/p-1
InChI Key:
CXCXTEMZMJZMJX-UHFFFAOYSA-M
SMILES:
COC(=O)C[P+](c1ccccc1)(c1ccccc1)c1ccccc1.[Cl-]
EC Number:
606-843-6
Properties
Complexity:
345
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
370.089g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
370.813g/mol
Monoisotopic Mass:
370.089g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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