Home Carboxys 1-cyano-5,6,7,8-tetrahydroindolizine-3-carboxylic acid

1-cyano-5,6,7,8-tetrahydroindolizine-3-carboxylic acid

CAS No.:
2138098-18-5
Catalog Number:
AG01EKWU
Molecular Formula:
C10H10N2O2
Molecular Weight:
190.1986
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Product Description
Catalog Number:
AG01EKWU
Chemical Name:
1-cyano-5,6,7,8-tetrahydroindolizine-3-carboxylic acid
CAS Number:
2138098-18-5
Molecular Formula:
C10H10N2O2
Molecular Weight:
190.1986
MDL Number:
MFCD31559208
IUPAC Name:
1-cyano-5,6,7,8-tetrahydroindolizine-3-carboxylic acid
InChI:
InChI=1S/C10H10N2O2/c11-6-7-5-9(10(13)14)12-4-2-1-3-8(7)12/h5H,1-4H2,(H,13,14)
InChI Key:
BCFNCCJWZCAOED-UHFFFAOYSA-N
SMILES:
N#Cc1cc(n2c1CCCC2)C(=O)O
Properties
Complexity:
294  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190.074g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
190.202g/mol
Monoisotopic Mass:
190.074g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
66A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
Properties