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Home > Boronic Acids > 659731-18-7
659731-18-7 | 3-(Pyrrolidino)phenylboronic acid
CAS No: 659731-18-7 Catalog No: AG0038JY MDL No:MFCD03095125
Product Description
Catalog Number:
AG0038JY
Chemical Name:
3-(Pyrrolidino)phenylboronic acid
CAS Number:
659731-18-7
Molecular Formula:
C10H14BNO2
Molecular Weight:
191.0347
MDL Number:
MFCD03095125
IUPAC Name:
(3-pyrrolidin-1-ylphenyl)boronic acid
InChI:
InChI=1S/C10H14BNO2/c13-11(14)9-4-3-5-10(8-9)12-6-1-2-7-12/h3-5,8,13-14H,1-2,6-7H2
InChI Key:
OADUVPSZJLNMCG-UHFFFAOYSA-N
SMILES:
OB(c1cccc(c1)N1CCCC1)O
Properties
Complexity:
183
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.112g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
191.037g/mol
Monoisotopic Mass:
191.112g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
43.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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