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5687-72-9

5687-72-9 | 2-Cyclopropylalanine

CAS No: 5687-72-9 Catalog No: AG003H51 MDL No:MFCD00039430

Product Description

Catalog Number:
AG003H51
Chemical Name:
2-Cyclopropylalanine
CAS Number:
5687-72-9
Molecular Formula:
C6H11NO2
Molecular Weight:
129.1570
MDL Number:
MFCD00039430
IUPAC Name:
2-amino-2-cyclopropylpropanoic acid
InChI:
InChI=1S/C6H11NO2/c1-6(7,5(8)9)4-2-3-4/h4H,2-3,7H2,1H3,(H,8,9)
InChI Key:
VRFYYCFVOBCXDL-UHFFFAOYSA-N
SMILES:
OC(=O)C(C1CC1)(N)C
NSC Number:
39061

Properties

Complexity:
142  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
129.079g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
129.159g/mol
Monoisotopic Mass:
129.079g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
63.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
-2.4  

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