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13869-17-5 | 1-Naphthalenol, 1,1',1''-phosphite
CAS No: 13869-17-5 Catalog No: AG00191D MDL No:
Product Description
Catalog Number:
AG00191D
Chemical Name:
1-Naphthalenol, 1,1',1''-phosphite
CAS Number:
13869-17-5
Molecular Formula:
C30H27O6P
Molecular Weight:
514.5055
IUPAC Name:
naphthalen-1-ol;phosphorous acid
InChI:
InChI=1S/3C10H8O.H3O3P/c3*11-10-7-3-5-8-4-1-2-6-9(8)10;1-4(2)3/h3*1-7,11H;1-3H
InChI Key:
DRQXEZNRZAHGCO-UHFFFAOYSA-N
SMILES:
Oc1cccc2c1cccc2.Oc1cccc2c1cccc2.Oc1cccc2c1cccc2.OP(O)O
Properties
Complexity:
141
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
4
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
514.155g/mol
Formal Charge:
0
Heavy Atom Count:
37
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
6
Isotope Atom Count:
0
Molecular Weight:
514.514g/mol
Monoisotopic Mass:
514.155g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
121A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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