Home Boronic acids B-[3-[(cyclopropylcarbonyl)amino]phenyl]boronic acid

B-[3-[(cyclopropylcarbonyl)amino]phenyl]boronic acid

CAS No.:
934543-06-3
Catalog Number:
AG00H5IH
Molecular Formula:
C10H12BNO3
Molecular Weight:
205.0182
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Product Description
Catalog Number:
AG00H5IH
Chemical Name:
B-[3-[(cyclopropylcarbonyl)amino]phenyl]boronic acid
CAS Number:
934543-06-3
Molecular Formula:
C10H12BNO3
Molecular Weight:
205.0182
MDL Number:
MFCD22573102
IUPAC Name:
[3-(cyclopropanecarbonylamino)phenyl]boronic acid
InChI:
InChI=1S/C10H12BNO3/c13-10(7-4-5-7)12-9-3-1-2-8(6-9)11(14)15/h1-3,6-7,14-15H,4-5H2,(H,12,13)
InChI Key:
DGXXULNJZFCUEP-UHFFFAOYSA-N
SMILES:
O=C(C1CC1)Nc1cccc(c1)B(O)O
Properties
Complexity:
243  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
205.091g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
205.02g/mol
Monoisotopic Mass:
205.091g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
69.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties