Boronicacid, B-[4-(chloromethyl)phenyl]-


Chemical Name: Boronicacid, B-[4-(chloromethyl)phenyl]-
CAS Number: 164413-77-8
Product Number: AG001UVG(AGN-PC-078T7T)
Synonyms:
MDL No: MFCD07363850
Molecular Formula: C7H8BClO2
Molecular Weight: 170.4012

Identification/Properties


Computed Properties
Molecular Weight:
170.399g/mol
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
2
Exact Mass:
170.031g/mol
Monoisotopic Mass:
170.031g/mol
Topological Polar Surface Area:
40.5A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
113
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
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#:
3261
Hazard Statements:
H314-H318
Precautionary Statements:
P280-P301+P330+P331-P305+P351+P338-P310
Class:
8
Packing Group:

NMR Spectrum


Other Analytical Data


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