AA81209
158747-10-5 | 4-(Methylamino)cyclohexanone 2,2-dimethyltrimethylene ketal hydrochloride
Manufacturer: A2B Chem
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CatalogNumber
AA81209
ChemicalName
4-(Methylamino)cyclohexanone 2,2-dimethyltrimethylene ketal hydrochloride
CasNumber
158747-10-5
MolecularFormula
C12H24ClNO2
MolecularWeight
249.7775
MdlNumber
MFCD01863581
Smiles
CNC1CCC2(CC1)OCC(CO2)(C)C.Cl
Complexity
208
Covalently-bondedUnitCount
2
HeavyAtomCount
16
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
2
RotatableBondCount
1
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CatalogNumber: AA81209
ChemicalName: 4-(Methylamino)cyclohexanone 2,2-dimethyltrimethylene ketal hydrochloride
CasNumber: 158747-10-5
MolecularFormula: C12H24ClNO2
MolecularWeight: 249.7775
MdlNumber: MFCD01863581
Smiles: CNC1CCC2(CC1)OCC(CO2)(C)C.Cl
Complexity: 208
Covalently-bondedUnitCount: 2
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: 1
CatalogNumber:
AA81209
ChemicalName:
4-(Methylamino)cyclohexanone 2,2-dimethyltrimethylene ketal hydrochloride
CasNumber:
158747-10-5
MolecularFormula:
C12H24ClNO2
MolecularWeight:
249.7775
MdlNumber:
MFCD01863581
Smiles:
CNC1CCC2(CC1)OCC(CO2)(C)C.Cl
Complexity:
208
Covalently-bondedUnitCount:
2
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C(OC(C)(C)C)N[C@@H](C(=O)O)Cc1cccc(c1)[N+](=O)[O-]
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C(OC(C)(C)C)N[C@@H](C(=O)O)Cc1cccc(c1)[N+](=O)[O-]
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
CatalogNumber: AA81213
ChemicalName: D-Norleucinol HCl
CasNumber: 158741-04-9
MolecularFormula: C6H16ClNO
MolecularWeight: 153.6503
MdlNumber: MFCD28986146
Smiles: CCCC[C@H](CO)N.Cl
Complexity: 47.8
Covalently-bondedUnitCount: 2
HeavyAtomCount: 9
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 3
RotatableBondCount: 4
CatalogNumber:
AA81213
ChemicalName:
D-Norleucinol HCl
CasNumber:
158741-04-9
MolecularFormula:
C6H16ClNO
MolecularWeight:
153.6503
MdlNumber:
MFCD28986146
Smiles:
CCCC[C@H](CO)N.Cl
Complexity:
47.8
Covalently-bondedUnitCount:
2
HeavyAtomCount:
9
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
3
RotatableBondCount:
4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: ClP(=O)(C1CCCCC1)C1CCCCC1
Complexity: 220
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
ClP(=O)(C1CCCCC1)C1CCCCC1
Complexity:
220
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__