Home Carboxys 3-oxa-7-azabicyclo[3.3.1]nonane-9-carboxylic acid hydrochloride, Mixture of diastereomers

3-oxa-7-azabicyclo[3.3.1]nonane-9-carboxylic acid hydrochloride, Mixture of diastereomers

CAS No.:
1427379-40-5
Catalog Number:
AG01A3VT
Molecular Formula:
C8H14ClNO3
Molecular Weight:
207.6547
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Product Description
Catalog Number:
AG01A3VT
Chemical Name:
3-oxa-7-azabicyclo[3.3.1]nonane-9-carboxylic acid hydrochloride, Mixture of diastereomers
CAS Number:
1427379-40-5
Molecular Formula:
C8H14ClNO3
Molecular Weight:
207.6547
MDL Number:
MFCD23144128
IUPAC Name:
3-oxa-7-azabicyclo[3.3.1]nonane-9-carboxylic acid;hydrochloride
InChI:
InChI=1S/C8H13NO3.ClH/c10-8(11)7-5-1-9-2-6(7)4-12-3-5;/h5-7,9H,1-4H2,(H,10,11);1H
InChI Key:
XUAHVJFIWCKLHG-UHFFFAOYSA-N
SMILES:
OC(=O)C1C2CNCC1COC2.Cl
Properties
Complexity:
183  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
207.066g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
207.654g/mol
Monoisotopic Mass:
207.066g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
58.6A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
Properties