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603122-41-4

603122-41-4 | 3-METHOXY-4-METHOXYCARBONYLPHENYLBORONIC ACID

CAS No: 603122-41-4 Catalog No: AG00EA07 MDL No:MFCD07366483

Product Description

Catalog Number:
AG00EA07
Chemical Name:
3-METHOXY-4-METHOXYCARBONYLPHENYLBORONIC ACID
CAS Number:
603122-41-4
Molecular Formula:
C9H11BO5
Molecular Weight:
209.9916
MDL Number:
MFCD07366483
IUPAC Name:
(3-methoxy-4-methoxycarbonylphenyl)boronic acid
InChI:
InChI=1S/C9H11BO5/c1-14-8-5-6(10(12)13)3-4-7(8)9(11)15-2/h3-5,12-13H,1-2H3
InChI Key:
YCXPWNGIPLGCOJ-UHFFFAOYSA-N
SMILES:
COC(=O)c1ccc(cc1OC)B(O)O

Properties

Complexity:
221  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.07g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
209.992g/mol
Monoisotopic Mass:
210.07g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
76A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

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