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1330529-77-5 | Tributyl[(3,5-dimethyl-4,5-dihydroisoxazol-4-yl)methyl]phosphonium chloride
CAS No: 1330529-77-5 Catalog No: AG01F4CK MDL No:
Product Description
Catalog Number:
AG01F4CK
Chemical Name:
Tributyl[(3,5-dimethyl-4,5-dihydroisoxazol-4-yl)methyl]phosphonium chloride
CAS Number:
1330529-77-5
Molecular Formula:
C18H37ClNOP
Molecular Weight:
349.9192
IUPAC Name:
tributyl-[(3,5-dimethyl-4,5-dihydro-1,2-oxazol-4-yl)methyl]phosphanium;chloride
InChI:
InChI=1S/C18H37NOP.ClH/c1-6-9-12-21(13-10-7-2,14-11-8-3)15-18-16(4)19-20-17(18)5;/h17-18H,6-15H2,1-5H3;1H/q+1;/p-1
InChI Key:
UEQKOKILTZSALH-UHFFFAOYSA-M
SMILES:
CCCC[P+](CC1C(C)ON=C1C)(CCCC)CCCC.[Cl-]
Properties
Complexity:
295
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
349.23g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
349.924g/mol
Monoisotopic Mass:
349.23g/mol
Rotatable Bond Count:
11
Topological Polar Surface Area:
21.6A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
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