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Home > Boronic Acids > 874290-83-2
874290-83-2 | 4-(benzylcarbamoyl)-2-nitrophenylboronic acid
CAS No: 874290-83-2 Catalog No: AG00IEJM MDL No:
Product Description
Catalog Number:
AG00IEJM
Chemical Name:
4-(benzylcarbamoyl)-2-nitrophenylboronic acid
CAS Number:
874290-83-2
IUPAC Name:
[4-(benzylcarbamoyl)-2-nitrophenyl]boronic acid
InChI:
InChI=1S/C14H13BN2O5/c18-14(16-9-10-4-2-1-3-5-10)11-6-7-12(15(19)20)13(8-11)17(21)22/h1-8,19-20H,9H2,(H,16,18)
InChI Key:
ODKOJFDKZKXKHS-UHFFFAOYSA-N
Properties
Complexity:
395
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
300.092g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
300.077g/mol
Monoisotopic Mass:
300.092g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
115A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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