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Home > Boronic Acids > 76410-59-8
76410-59-8 | L-Phenylalanine, 4-borono-, HCl
CAS No: 76410-59-8 Catalog No: AG00ICQI MDL No:
Product Description
Catalog Number:
AG00ICQI
Chemical Name:
L-Phenylalanine, 4-borono-, HCl
CAS Number:
76410-59-8
IUPAC Name:
(2S)-2-amino-3-(4-boronophenyl)propanoic acid;hydrochloride
InChI:
InChI=1S/C9H12BNO4.ClH/c11-8(9(12)13)5-6-1-3-7(4-2-6)10(14)15;/h1-4,8,14-15H,5,11H2,(H,12,13);1H/t8-;/m0./s1
InChI Key:
ITAYDCRFNXQNBL-QRPNPIFTSA-N
UNII:
O37300B3AP
Properties
Complexity:
216
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
245.063g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
5
Isotope Atom Count:
0
Molecular Weight:
245.466g/mol
Monoisotopic Mass:
245.063g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
104A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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