(1S)-3-chloro-1-phenylpropan-1-ol


Chemical Name: (1S)-3-chloro-1-phenylpropan-1-ol
CAS Number: 18776-12-0
Product Number: AG000OJR(AGN-PC-008LNA)
Synonyms:
MDL No:
Molecular Formula: C9H11ClO
Molecular Weight: 170.6360

Identification/Properties


Computed Properties
Molecular Weight:
170.636g/mol
XLogP3:
2
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
3
Exact Mass:
170.05g/mol
Monoisotopic Mass:
170.05g/mol
Topological Polar Surface Area:
20.2A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
99.7
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

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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