AB69912
1078-19-9 | 6-Methoxy-1-tetralone
Manufacturer: A2B Chem
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CatalogNumber
AB69912
ChemicalName
6-Methoxy-1-tetralone
CasNumber
1078-19-9
MolecularFormula
C11H12O2
MolecularWeight
176.21178000000006
MdlNumber
MFCD00001695
Smiles
COc1ccc2c(c1)CCCC2=O
NscNumber
41700
Complexity
200
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
2
RotatableBondCount
1
Xlogp3
2
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CatalogNumber: AB69912
ChemicalName: 6-Methoxy-1-tetralone
CasNumber: 1078-19-9
MolecularFormula: C11H12O2
MolecularWeight: 176.21178000000006
MdlNumber: MFCD00001695
Smiles: COc1ccc2c(c1)CCCC2=O
NscNumber: 41700
Complexity: 200
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 2
RotatableBondCount: 1
Xlogp3: 2
CatalogNumber:
AB69912
ChemicalName:
6-Methoxy-1-tetralone
CasNumber:
1078-19-9
MolecularFormula:
C11H12O2
MolecularWeight:
176.21178000000006
MdlNumber:
MFCD00001695
Smiles:
COc1ccc2c(c1)CCCC2=O
NscNumber:
41700
Complexity:
200
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
2
RotatableBondCount:
1
Xlogp3:
2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCCC[Sn](c1nccc(n1)OC)(CCCC)CCCC
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCCC[Sn](c1nccc(n1)OC)(CCCC)CCCC
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AB69914
ChemicalName: 2-Methoxy-5-nitro-6-picoline
CasNumber: 5467-69-6
MolecularFormula: C7H8N2O3
MolecularWeight: 168.15
MdlNumber: MFCD03095076
Smiles: COc1ccc(c(n1)C)[N+](=O)[O-]
NscNumber: 25401
Complexity: 169
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 4
RotatableBondCount: 1
Xlogp3: 1.4
CatalogNumber:
AB69914
ChemicalName:
2-Methoxy-5-nitro-6-picoline
CasNumber:
5467-69-6
MolecularFormula:
C7H8N2O3
MolecularWeight:
168.15
MdlNumber:
MFCD03095076
Smiles:
COc1ccc(c(n1)C)[N+](=O)[O-]
NscNumber:
25401
Complexity:
169
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
4
RotatableBondCount:
1
Xlogp3:
1.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COc1ccc2c(c1)sc(n2)C
NscNumber: __
Complexity: 165
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 2.8
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COc1ccc2c(c1)sc(n2)C
NscNumber:
__
Complexity:
165
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
2.8