Home Other Building Blocks 3-(3-OXOPIPERAZIN-1-YL)PROPANOIC ACID

3-(3-OXOPIPERAZIN-1-YL)PROPANOIC ACID

CAS No.:
1036592-02-5
Catalog Number:
AG01ARHD
Molecular Formula:
C7H12N2O3
Molecular Weight:
172.1818
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Product Description
Catalog Number:
AG01ARHD
Chemical Name:
3-(3-OXOPIPERAZIN-1-YL)PROPANOIC ACID
CAS Number:
1036592-02-5
Molecular Formula:
C7H12N2O3
Molecular Weight:
172.1818
MDL Number:
MFCD10698220
IUPAC Name:
3-(3-oxopiperazin-1-yl)propanoic acid
InChI:
InChI=1S/C7H12N2O3/c10-6-5-9(4-2-8-6)3-1-7(11)12/h1-5H2,(H,8,10)(H,11,12)
InChI Key:
MEPQLYCZCYIEQT-UHFFFAOYSA-N
SMILES:
OC(=O)CCN1CCNC(=O)C1
Properties
Complexity:
193  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
172.085g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
172.184g/mol
Monoisotopic Mass:
172.085g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
69.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-3.4  
Properties