1,2-Propanediol, 3-(4-chlorophenoxy)-


Chemical Name: 1,2-Propanediol, 3-(4-chlorophenoxy)-
CAS Number: 104-29-0
Product Number: AG007I5N(AGN-PC-0JK87Q)
Synonyms:
MDL No:
Molecular Formula: C9H11ClO3
Molecular Weight: 202.6348

Identification/Properties


Computed Properties
Molecular Weight:
202.634g/mol
XLogP3:
1.2
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
4
Exact Mass:
202.04g/mol
Monoisotopic Mass:
202.04g/mol
Topological Polar Surface Area:
49.7A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
135
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

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NMR Spectrum


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