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Home > Boronic Acids > 723281-53-6
723281-53-6 | (3-(Pyrrolidine-1-carbonyl)phenyl)boronic acid
CAS No: 723281-53-6 Catalog No: AG0067FR MDL No:MFCD04115685
Product Description
Catalog Number:
AG0067FR
Chemical Name:
(3-(Pyrrolidine-1-carbonyl)phenyl)boronic acid
CAS Number:
723281-53-6
Molecular Formula:
C11H14BNO3
Molecular Weight:
219.0448
MDL Number:
MFCD04115685
IUPAC Name:
[3-(pyrrolidine-1-carbonyl)phenyl]boronic acid
InChI:
InChI=1S/C11H14BNO3/c14-11(13-6-1-2-7-13)9-4-3-5-10(8-9)12(15)16/h3-5,8,15-16H,1-2,6-7H2
InChI Key:
SXTMJRKRWYTPLI-UHFFFAOYSA-N
SMILES:
O=C(c1cccc(c1)B(O)O)N1CCCC1
Properties
Complexity:
254
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
219.107g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
219.047g/mol
Monoisotopic Mass:
219.107g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
60.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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