Home Carboxys 2-?Azetidinecarboxylic acid,3-ethyl-1-methyl, (2S)?-

2-?Azetidinecarboxylic acid,3-ethyl-1-methyl, (2S)?-

CAS No.:
1860067-55-5
Catalog Number:
AG00IKQM
Molecular Formula:
C7H13NO2
Molecular Weight:
143.1836
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Product Description
Catalog Number:
AG00IKQM
Chemical Name:
2-?Azetidinecarboxylic acid,3-ethyl-1-methyl, (2S)?-
CAS Number:
1860067-55-5
Molecular Formula:
C7H13NO2
Molecular Weight:
143.1836
IUPAC Name:
(2S)-3-ethyl-1-methylazetidine-2-carboxylic acid
InChI:
InChI=1S/C7H13NO2/c1-3-5-4-8(2)6(5)7(9)10/h5-6H,3-4H2,1-2H3,(H,9,10)/t5?,6-/m0/s1
InChI Key:
GIYAAEWDHLFROB-GDVGLLTNSA-N
SMILES:
CCC1CN([C@@H]1C(=O)O)C
Properties
Complexity:
147  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
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:
2  
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.5  
Properties