Home Boronic Acids 1003042-59-8
1003042-59-8,MFCD06656270
Catalog No.:AA0001GX
1003042-59-8 | Boronic acid, B-[2-chloro-5-(hydroxymethyl)phenyl]-
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Purity
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Price(USD)
Quantity
  
1g
97%
in stock  
$39.00
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5g
97%
in stock  
$119.00
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25g
97%
in stock  
$400.00
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  • Technical Information
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Technical Information
Catalog Number:
AA0001GX
Chemical Name:
Boronic acid, B-[2-chloro-5-(hydroxymethyl)phenyl]-
CAS Number:
1003042-59-8
Molecular Formula:
C7H8BClO3
Molecular Weight:
186.4006
MDL Number:
MFCD06656270
IUPAC Name:
[2-chloro-5-(hydroxymethyl)phenyl]boronic acid
InChI:
InChI=1S/C7H8BClO3/c9-7-2-1-5(4-10)3-6(7)8(11)12/h1-3,10-12H,4H2
InChI Key:
OMQUJFBGPRFTIO-UHFFFAOYSA-N
SMILES:
OCc1ccc(c(c1)B(O)O)Cl
Properties
Computed 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

Synonyms
 
2-Chloro-5-hydroxymethylphenylboronic acid 
1003042-59-8 
CTK3J4634 
DTXSID00590370 
OMQUJFBGPRFTIO-UHFFFAOYSA-N 
BM580 
ZX-AT004458 
ANW-14215 
FCH921303 
MFCD06656270 
OR9493 
AKOS006344214 
2-chloro-5-(hydroxymethyl)phenylboronic acid 
ZINC169747848 
AB25499 
PS-9608 
RTR-000107 
AK-45853 
AM802820 
BC000977 
AB0029150 
AX8008035 
DB-010387 
2-Chloro-5-(hydroxymethyl)benzeneboronic acid 
TR-000107 
FT-0678851 
ST24040372 
X1289 
C-1672 
0042C59 
Boronicacid,B-[2-chloro-5-(hydroxymethyl)phenyl]- 
I04-2496 
2-chloro-5-hydroxymethylphenylboronic acid, AldrichCPR 
C7H8BClO3 
[2-chloro-5-(hydroxymethyl)phenyl]boronic acid 
cc-639 
ACN-034285 
1072952-25-0 
2-Chloro-5-hydroxymethylphenylboronicacid 
BORONIC ACID, B-[2-CHLORO-5-(HYDROXYMETHYL)PHENYL]- 
KSC494M3J 
ACMC-2097o9 
SCHEMBL2533149 
Literature
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