Home Carboxys methyl 2-oxa-5-azabicyclo[2.2.1]heptane-4-carboxylate hydrochloride

methyl 2-oxa-5-azabicyclo[2.2.1]heptane-4-carboxylate hydrochloride

CAS No.:
2137451-00-2
Catalog Number:
AG01EJA2
Molecular Formula:
C7H12ClNO3
Molecular Weight:
193.6281
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Product Description
Catalog Number:
AG01EJA2
Chemical Name:
methyl 2-oxa-5-azabicyclo[2.2.1]heptane-4-carboxylate hydrochloride
CAS Number:
2137451-00-2
Molecular Formula:
C7H12ClNO3
Molecular Weight:
193.6281
MDL Number:
MFCD31559386
IUPAC Name:
methyl 2-oxa-5-azabicyclo[2.2.1]heptane-4-carboxylate;hydrochloride
InChI:
InChI=1S/C7H11NO3.ClH/c1-10-6(9)7-2-5(3-8-7)11-4-7;/h5,8H,2-4H2,1H3;1H
InChI Key:
IDSMYFLFFRTZPK-UHFFFAOYSA-N
SMILES:
COC(=O)C12COC(C2)CN1.Cl
Properties
Complexity:
194  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
193.051g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
193.627g/mol
Monoisotopic Mass:
193.051g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
47.6A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
Properties