CC(C)(C)OC(=O)N1C2CCC(C2)C1C(=O)O
CAS: 134795-25-8
Name: 2-[(2-methylpropan-2-yl)oxycarbonyl]-2-azabicyclo[2.2.1]heptane-3-carboxylic acid
SMILES: CC(C)(C)OC(=O)N1C2CCC(C2)C1C(=O)O

Molecular Processing

Molecular formula
C12H19NO4
Molecular weight
241.29
Exact mass
241.1314
XLogP
1.86
TPSA
66.84
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
17
Rings
2
Aromatic rings
0
Saturated rings
2
Aliphatic rings
2
Stereo centers
3
Undefined stereo
3
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.833
Molar refractivity
60.63

Supplementary Information

InChIKey: IFAMSTPTNRJBRG-UHFFFAOYSA-N
Synonyme
134795-25-82-(tert-Butoxycarbonyl)-2-azabicyclo[2.2.1]heptane-3-carboxylic acid(3S)-2-(TERT-BUTOXYCARBONYL)-2-AZABICYCLO[2.2.1]HEPTANE-3-CARBOXYLIC ACIDMFCD179265522-[(2-methylpropan-2-yl)oxycarbonyl]-2-azabicyclo[2.2.1]heptane-3-carboxylic acid2-[(tert-butoxy)carbonyl]-2-azabicyclo[2.2.1]heptane-3-carboxylic acid(3S)-N-BOC-2-AZABICYCLO[2.2.1]HEPTANE-3-CARBOXYLIC ACID(1S,3R,4R)-2-[(tert-butoxy)carbonyl]-2-azabicyclo[2.2.1]heptane-3-carboxylic acid(1S,3R,4S)-2-(TERT-BUTOXYCARBONYL)-2-AZABICYCLO[2.2.1]HEPTANE-3-CARBOXYLIC ACIDIFAMSTPTNRJBRG-UHFFFAOYSA-NSCHEMBL203763JFA795252-(tert-Butoxycarbonyl)-2-azabicyclo[2.2.1]heptane-3-carboxylicacidAKOS016007952AB86149SB15907SB15908AS-41719DB-063042CS-0135331NS00002228EN300-297487F2328982-(t-Butoxycarbonyl)-2-azabicyclo[2.2.1]heptane-3-carboxylic acid2-tert-butoxycarbonyl-2-azabicyclo[2.2.1]heptane-3-carboxylic acid2-aza-bicyclo[2.2.1]heptane-2,3-dicarboxylic acid 2-tert-butyl ester2-Azabicyclo[2.2.1]heptane-2,3-dicarboxylic acid 2-tert-butyl ester(1R,3S,4R)-2-(tert-Butoxycarbonyl)-2-azabicyclo-[2.2.1]heptane-3-carboxylic acid2-[(tert-butoxy)carbonyl]-2-azabicyclo[2.2.1]heptane-3-carboxylic acid, Mixture of diastereomers2-Azabicyclo[2.2.1]heptane-2,3-dicarboxylic acid, 2-(1,1-diMethylethyl) ester, (1R-endo)- (9CI)
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