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72283-31-9

72283-31-9 | 2-phenoxyethanol; phosphoric acid

CAS No: 72283-31-9 Catalog No: AG005IFT MDL No:

Product Description

Catalog Number:
AG005IFT
Chemical Name:
2-phenoxyethanol; phosphoric acid
CAS Number:
72283-31-9
Molecular Formula:
C8H13O6P
Molecular Weight:
236.1590
IUPAC Name:
2-phenoxyethanol;phosphoric acid
InChI:
InChI=1S/C8H10O2.H3O4P/c9-6-7-10-8-4-2-1-3-5-8;1-5(2,3)4/h1-5,9H,6-7H2;(H3,1,2,3,4)
InChI Key:
WUSMTFVMXOQYCT-UHFFFAOYSA-N
SMILES:
OP(=O)(O)O.OCCOc1ccccc1
EC Number:
609-691-9

Properties

Complexity:
127  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.045g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0
Molecular Weight:
236.16g/mol
Monoisotopic Mass:
236.045g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
107A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

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