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Home > Boronic Acids > 3088-78-6
3088-78-6 | Boronic acid, B-nonyl-
CAS No: 3088-78-6 Catalog No: AG0031JX MDL No:
Product Description
Catalog Number:
AG0031JX
Chemical Name:
Boronic acid, B-nonyl-
CAS Number:
3088-78-6
Molecular Formula:
C9H21BO2
Molecular Weight:
172.0728
IUPAC Name:
nonylboronic acid
InChI:
InChI=1S/C9H21BO2/c1-2-3-4-5-6-7-8-9-10(11)12/h11-12H,2-9H2,1H3
InChI Key:
RHPOAOZKVCLNPE-UHFFFAOYSA-N
SMILES:
CCCCCCCCCB(O)O
NSC Number:
53325
Properties
Complexity:
86.6
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
172.163g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
172.075g/mol
Monoisotopic Mass:
172.163g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Literature
| Title | Journal |
|---|---|
| Dipeptide boronic acid inhibitors of dipeptidyl peptidase IV: determinants of potency and in vivo efficacy and safety. | Journal of medicinal chemistry 20081009 |
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