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76234-38-3 | 3-pyrrolidin-1-ylpropionic acid
CAS No: 76234-38-3 Catalog No: AG0035YV MDL No:MFCD04114076
Product Description
Catalog Number:
AG0035YV
Chemical Name:
3-pyrrolidin-1-ylpropionic acid
CAS Number:
76234-38-3
Molecular Formula:
C7H13NO2
Molecular Weight:
143.1836
MDL Number:
MFCD04114076
IUPAC Name:
3-pyrrolidin-1-ylpropanoic acid
InChI:
InChI=1S/C7H13NO2/c9-7(10)3-6-8-4-1-2-5-8/h1-6H2,(H,9,10)
InChI Key:
BRSKDXVJFXXUKX-UHFFFAOYSA-N
SMILES:
OC(=O)CCN1CCCC1
Properties
Complexity:
119
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
143.095g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
143.186g/mol
Monoisotopic Mass:
143.095g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-2
Literature
| Title | Journal |
|---|---|
| Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. | Bioorganic & medicinal chemistry letters 20101101 |
| CCR5 antagonists: 3-(pyrrolidin-1-yl)propionic acid analogues with potent anti-HIV activity. | Organic letters 20030710 |
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