Home Boronic acids 4-Chloro-3-(hydroxymethyl)phenylboronic acid

4-Chloro-3-(hydroxymethyl)phenylboronic acid

CAS No.:
1430237-54-9
Catalog Number:
AG00HWS2
Molecular Formula:
C7H8BClO3
Molecular Weight:
186.4006
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$688
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Product Description
Catalog Number:
AG00HWS2
Chemical Name:
4-Chloro-3-(hydroxymethyl)phenylboronic acid
CAS Number:
1430237-54-9
Molecular Formula:
C7H8BClO3
Molecular Weight:
186.4006
MDL Number:
MFCD28122667
IUPAC Name:
[4-chloro-3-(hydroxymethyl)phenyl]boronic acid
InChI:
InChI=1S/C7H8BClO3/c9-7-2-1-6(8(11)12)3-5(7)4-10/h1-3,10-12H,4H2
InChI Key:
QYYROAZVVUGRER-UHFFFAOYSA-N
SMILES:
OCc1cc(ccc1Cl)B(O)O
Properties
Complexity:
145  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
186.026g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
186.398g/mol
Monoisotopic Mass:
186.026g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
60.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties