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Home > Boronic Acids > 1704069-21-5
1704069-21-5 | (3-((2-Methoxyphenyl)carbaMoyl)phenyl)boronic acid
CAS No: 1704069-21-5 Catalog No: AG00AR7Q MDL No:MFCD28384303
Product Description
Catalog Number:
AG00AR7Q
Chemical Name:
(3-((2-Methoxyphenyl)carbaMoyl)phenyl)boronic acid
CAS Number:
1704069-21-5
Molecular Formula:
C14H14BNO4
Molecular Weight:
271.0763
MDL Number:
MFCD28384303
IUPAC Name:
[3-[(2-methoxyphenyl)carbamoyl]phenyl]boronic acid
InChI:
InChI=1S/C14H14BNO4/c1-20-13-8-3-2-7-12(13)16-14(17)10-5-4-6-11(9-10)15(18)19/h2-9,18-19H,1H3,(H,16,17)
InChI Key:
JCVYOHCBRLCUSA-UHFFFAOYSA-N
SMILES:
COc1ccccc1NC(=O)c1cccc(c1)B(O)O
Properties
Complexity:
326
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
271.102g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
271.079g/mol
Monoisotopic Mass:
271.102g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
78.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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