AB47810
153749-89-4 | tert-Butyl 2-cyanopiperidine-1-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AB47810
ChemicalName
tert-Butyl 2-cyanopiperidine-1-carboxylate
CasNumber
153749-89-4
MolecularFormula
C11H18N2O2
MolecularWeight
210.2728
MdlNumber
MFCD01861221
Smiles
N#CC1CCCCN1C(=O)OC(C)(C)C
Complexity
285
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
3
RotatableBondCount
2
UndefinedAtomStereocenterCount
1
Xlogp3
1.8
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CatalogNumber: AB47810
ChemicalName: tert-Butyl 2-cyanopiperidine-1-carboxylate
CasNumber: 153749-89-4
MolecularFormula: C11H18N2O2
MolecularWeight: 210.2728
MdlNumber: MFCD01861221
Smiles: N#CC1CCCCN1C(=O)OC(C)(C)C
Complexity: 285
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 3
RotatableBondCount: 2
UndefinedAtomStereocenterCount: 1
Xlogp3: 1.8
CatalogNumber:
AB47810
ChemicalName:
tert-Butyl 2-cyanopiperidine-1-carboxylate
CasNumber:
153749-89-4
MolecularFormula:
C11H18N2O2
MolecularWeight:
210.2728
MdlNumber:
MFCD01861221
Smiles:
N#CC1CCCCN1C(=O)OC(C)(C)C
Complexity:
285
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
3
RotatableBondCount:
2
UndefinedAtomStereocenterCount:
1
Xlogp3:
1.8
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=CNc1scc(n1)C(=O)C(=O)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=CNc1scc(n1)C(=O)C(=O)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
CatalogNumber: AB47812
ChemicalName: H-Allo-Thr-OMe HCl
CasNumber: 79617-27-9
MolecularFormula: C5H12ClNO3
MolecularWeight: 169.6067
MdlNumber: MFCD00237766
Smiles: COC(=O)[C@H]([C@@H](O)C)N.Cl
Complexity: 104
Covalently-bondedUnitCount: 2
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 4
RotatableBondCount: 3
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
AB47812
ChemicalName:
H-Allo-Thr-OMe HCl
CasNumber:
79617-27-9
MolecularFormula:
C5H12ClNO3
MolecularWeight:
169.6067
MdlNumber:
MFCD00237766
Smiles:
COC(=O)[C@H]([C@@H](O)C)N.Cl
Complexity:
104
Covalently-bondedUnitCount:
2
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
4
RotatableBondCount:
3
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CC(=O)c1c(C)c2cnc(nc2n(c1=O)C1CCCC1)Nc1ccc(cn1)N1CCNCC1
Complexity: 775
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: 1.8
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CC(=O)c1c(C)c2cnc(nc2n(c1=O)C1CCCC1)Nc1ccc(cn1)N1CCNCC1
Complexity:
775
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
1.8