1,2-Propanediol, 3-bromo-


Chemical Name: 1,2-Propanediol, 3-bromo-
CAS Number: 4704-77-2
Product Number: AG00DEOM(AGN-PC-0JKFIP)
Synonyms:
MDL No:
Molecular Formula: C3H7BrO2
Molecular Weight: 154.9905

Identification/Properties


Computed Properties
Molecular Weight:
154.991g/mol
XLogP3:
-0.3
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
2
Exact Mass:
153.963g/mol
Monoisotopic Mass:
153.963g/mol
Topological Polar Surface Area:
40.5A^2
Heavy Atom Count:
6
Formal Charge:
0
Complexity:
32
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:
Danger
UN#:
2811
Hazard Statements:
H301-H311-H331-H341
Precautionary Statements:
P201-P202-P261-P264-P270-P271-P280-P302+P352-P304+P340-P308+P313-P310-P330+P313-P361-P403+P233-P405-P501
Class:
6.1
Packing Group:

NMR Spectrum


Other Analytical Data


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