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1024038-72-9,MFCD11099878
Catalog No.:AA0007AS
1024038-72-9 | Methyl (1r,5s,6r)-3-azabicyclo[3.1.0]hexane-6-carboxylate hydrochloride
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250mg
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$400.00   $280.00
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Technical Information
Catalog Number:
AA0007AS
Chemical Name:
Methyl (1r,5s,6r)-3-azabicyclo[3.1.0]hexane-6-carboxylate hydrochloride
CAS Number:
1024038-72-9
Molecular Formula:
C7H12ClNO2
Molecular Weight:
177.6287
MDL Number:
MFCD11099878
IUPAC Name:
methyl (1S,5R)-3-azabicyclo[3.1.0]hexane-6-carboxylate;hydrochloride
InChI:
InChI=1S/C7H11NO2.ClH/c1-10-7(9)6-4-2-8-3-5(4)6;/h4-6,8H,2-3H2,1H3;1H/t4-,5+,6?;
InChI Key:
FINRNZAMIJPDPU-FTEHNKOGSA-N
SMILES:
COC(=O)[C@@H]1[C@@H]2[C@H]1CNC2.Cl
Properties
Computed Properties
 
Complexity:
159  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
2  
Defined Bond Stereocenter Count:
0
Exact Mass:
177.056g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
177.628g/mol
Monoisotopic Mass:
177.056g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

Synonyms
 
1212063-26-7 
Methyl exo-3-azabicyclo[3.1.0]hexane-6-carboxylate hydrochloride 
MFCD28168090 
AKOS025289605 
AKOS030631170 
NE52112 
PB35921 
SB10922 
AS-50769 
methyl (1R,5S,6S)-3-azabicyclo[3.1.0]hexane-6-carboxylate hydrochloride 
Methyl rac-(1R,5S,6R)-3-azabicyclo[3.1.0]hexane-6-carboxylate HCl 
methyl rel-(1r,5s,6r)-3-azabicyclo[3.1.0]hexane-6-carboxylate hcl 
methyl (1R,5S,6R)-3-azabicyclo[3.1.0]hexane-6-carboxylate hydrochloride 
1024038-72-9 
EN300-51636 
(1R,5S,6r)-Methyl 3-azabicyclo[3.1.0]hexane-6-carboxylate hydrochloride 
METHYL (1R,5S)-3-AZABICYCLO[3.1.0]HEXANE-6-CARBOXYLATE HYDROCHLORIDE 
Methyl rac-(1R,5S,6S)-3-azabicyclo[3.1.0]hexane-6-carboxylate hydrochloride 
CTK6I8006 
MFCD11099878 
Literature
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