Home Carboxys 3-Azabicyclo[3.1.0]hexane-1-carboxylic acid, ethyl ester, hydrochloride (1:1)

3-Azabicyclo[3.1.0]hexane-1-carboxylic acid, ethyl ester, hydrochloride (1:1)

CAS No.:
1989558-84-0
Catalog Number:
AG002BT4
Molecular Formula:
C8H14ClNO2
Molecular Weight:
191.6553
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Product Description
Catalog Number:
AG002BT4
Chemical Name:
3-Azabicyclo[3.1.0]hexane-1-carboxylic acid, ethyl ester, hydrochloride (1:1)
CAS Number:
1989558-84-0
Molecular Formula:
C8H14ClNO2
Molecular Weight:
191.6553
MDL Number:
MFCD28148293
IUPAC Name:
ethyl 3-azabicyclo[3.1.0]hexane-1-carboxylate;hydrochloride
InChI:
InChI=1S/C8H13NO2.ClH/c1-2-11-7(10)8-3-6(8)4-9-5-8;/h6,9H,2-5H2,1H3;1H
InChI Key:
CXLVMVRPIVJYLB-UHFFFAOYSA-N
SMILES:
CCOC(=O)C12CNCC2C1.Cl
Properties
Complexity:
193  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.071g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
191.655g/mol
Monoisotopic Mass:
191.071g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
Properties