Home Boronic Acids 1003298-84-7
1003298-84-7,MFCD05663844
Catalog No.:AA0001JG
1003298-84-7 | Phenol, 2-chloro-6-methoxy-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-
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1g
96%
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$256.00
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5g
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$917.00
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Technical Information
Catalog Number:
AA0001JG
Chemical Name:
Phenol, 2-chloro-6-methoxy-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-
CAS Number:
1003298-84-7
Molecular Formula:
C13H18BClO4
Molecular Weight:
284.5436
MDL Number:
MFCD05663844
IUPAC Name:
2-chloro-6-methoxy-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenol
InChI:
InChI=1S/C13H18BClO4/c1-12(2)13(3,4)19-14(18-12)8-6-9(15)11(16)10(7-8)17-5/h6-7,16H,1-5H3
InChI Key:
XBEJPOZGAPQFPL-UHFFFAOYSA-N
SMILES:
COc1cc(cc(c1O)Cl)B1OC(C(O1)(C)C)(C)C
Properties
Computed Properties
 
Complexity:
321  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
284.099g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
284.543g/mol
Monoisotopic Mass:
284.099g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
47.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

Synonyms
 
1003298-84-7 
3-CHLORO-4-HYDROXY-5-METHOXYPHENYLBORONIC ACID, PINACOL ESTER 
BM175 
ZXBA000150 
ZX-RL003503 
ANW-42620 
MFCD05663844 
AKOS015960143 
ZINC169743568 
AB21930 
BS-2032 
FCH2806511 
2-Chloro-6-methoxy-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenol 
KS-0000231Y 
OR310219 
AX8281785 
RT-016746 
A-4047 
J-000104 
3-Chloro-4-hydroxy-5-methoxyphenylboronicacid, pinacol ester 
2-chloro-6-methoxy-4-(tetramethyl-1,3,2-dioxaborolan-2-yl)phenol 
PHENOL, 2-CHLORO-6-METHOXY-4-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)- 
3-Chloro-4-hydroxy-5-methoxyphenylboronic acid pinacol ester 
3-Chloro-4-hydroxy-5-methoxyphenylboronic acid pinacol ester, 97% 
3-Chloro-4-hydroxy-5-methoxyphenylboronic acid, pinacol ester, AldrichCPR 
SCHEMBL529553 
CTK8B3499 
DTXSID90590369 
XBEJPOZGAPQFPL-UHFFFAOYSA-N 
Literature
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