AA33594
120013-39-0 | 5,6-Dimethoxy-2-(4-piperidinylmethyl)-1-indanone, HCl
Manufacturer: A2B Chem
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CatalogNumber
AA33594
ChemicalName
5,6-Dimethoxy-2-(4-piperidinylmethyl)-1-indanone, HCl
CasNumber
120013-39-0
MolecularFormula
C17H24ClNO3
MolecularWeight
325.8304
MdlNumber
MFCD09033179
Smiles
COc1cc2c(cc1OC)CC(C2=O)CC1CCNCC1.Cl
Complexity
367
Covalently-bondedUnitCount
2
HeavyAtomCount
22
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
2
RotatableBondCount
4
UndefinedAtomStereocenterCount
1
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CatalogNumber: AA33594
ChemicalName: 5,6-Dimethoxy-2-(4-piperidinylmethyl)-1-indanone, HCl
CasNumber: 120013-39-0
MolecularFormula: C17H24ClNO3
MolecularWeight: 325.8304
MdlNumber: MFCD09033179
Smiles: COc1cc2c(cc1OC)CC(C2=O)CC1CCNCC1.Cl
Complexity: 367
Covalently-bondedUnitCount: 2
HeavyAtomCount: 22
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 4
UndefinedAtomStereocenterCount: 1
CatalogNumber:
AA33594
ChemicalName:
5,6-Dimethoxy-2-(4-piperidinylmethyl)-1-indanone, HCl
CasNumber:
120013-39-0
MolecularFormula:
C17H24ClNO3
MolecularWeight:
325.8304
MdlNumber:
MFCD09033179
Smiles:
COc1cc2c(cc1OC)CC(C2=O)CC1CCNCC1.Cl
Complexity:
367
Covalently-bondedUnitCount:
2
HeavyAtomCount:
22
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
4
UndefinedAtomStereocenterCount:
1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
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Smiles: COc1cc2c(cc1OC)CC(C2O)CC1CCN(CC1)Cc1ccccc1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
COc1cc2c(cc1OC)CC(C2O)CC1CCN(CC1)Cc1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COc1cc2c(cc1OC)CC(C2=O)CC1CCN(CC1)Cc1ccccc1.Cl
Complexity: 510
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COc1cc2c(cc1OC)CC(C2=O)CC1CCN(CC1)Cc1ccccc1.Cl
Complexity:
510
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCCCCCCCCCCCCC#CC(=O)[C@@H]1COC(N1C(=O)OC(C)(C)C)(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCCCCCCCCCCCCC#CC(=O)[C@@H]1COC(N1C(=O)OC(C)(C)C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__