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161928-40-1 | Boronic acid, (1-aminoethyl)- (9CI)
CAS No: 161928-40-1 Catalog No: AG001SIN MDL No:
Product Description
Catalog Number:
AG001SIN
Chemical Name:
Boronic acid, (1-aminoethyl)- (9CI)
CAS Number:
161928-40-1
Molecular Formula:
C2H8BNO2
Molecular Weight:
88.9014
IUPAC Name:
1-aminoethylboronic acid
InChI:
InChI=1S/C2H8BNO2/c1-2(4)3(5)6/h2,5-6H,4H2,1H3
InChI Key:
MEJXSZPJYPOEIL-UHFFFAOYSA-N
SMILES:
OB(C(N)C)O
Properties
Complexity:
40.5
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
89.065g/mol
Formal Charge:
0
Heavy Atom Count:
6
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
88.901g/mol
Monoisotopic Mass:
89.065g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
66.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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