AB44939
944109-65-3 | 4-Chloro-5-methoxy-1-indanone
Manufacturer: A2B Chem
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CatalogNumber
AB44939
ChemicalName
4-Chloro-5-methoxy-1-indanone
CasNumber
944109-65-3
MolecularFormula
C10H9ClO2
MolecularWeight
196.6303
MdlNumber
MFCD09836228
Smiles
COc1ccc2c(c1Cl)CCC2=O
Complexity
217
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
2
RotatableBondCount
1
Xlogp3
2.3
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CatalogNumber: AB44939
ChemicalName: 4-Chloro-5-methoxy-1-indanone
CasNumber: 944109-65-3
MolecularFormula: C10H9ClO2
MolecularWeight: 196.6303
MdlNumber: MFCD09836228
Smiles: COc1ccc2c(c1Cl)CCC2=O
Complexity: 217
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 2
RotatableBondCount: 1
Xlogp3: 2.3
CatalogNumber:
AB44939
ChemicalName:
4-Chloro-5-methoxy-1-indanone
CasNumber:
944109-65-3
MolecularFormula:
C10H9ClO2
MolecularWeight:
196.6303
MdlNumber:
MFCD09836228
Smiles:
COc1ccc2c(c1Cl)CCC2=O
Complexity:
217
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
2
RotatableBondCount:
1
Xlogp3:
2.3
CatalogNumber: AB44940
ChemicalName: 4-Chloro-6-(trifluoromethyl)quinazoline
CasNumber: 16499-64-2
MolecularFormula: C9H4ClF3N2
MolecularWeight: 232.5897
MdlNumber: MFCD09837194
Smiles: Clc1ncnc2c1cc(cc2)C(F)(F)F
Complexity: 234
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 5
RotatableBondCount: __
Xlogp3: 3.4
CatalogNumber:
AB44940
ChemicalName:
4-Chloro-6-(trifluoromethyl)quinazoline
CasNumber:
16499-64-2
MolecularFormula:
C9H4ClF3N2
MolecularWeight:
232.5897
MdlNumber:
MFCD09837194
Smiles:
Clc1ncnc2c1cc(cc2)C(F)(F)F
Complexity:
234
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
5
RotatableBondCount:
__
Xlogp3:
3.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C=Nc1cc(N=C=O)c(cc1C)Cl
Complexity: 295
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 4.5
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C=Nc1cc(N=C=O)c(cc1C)Cl
Complexity:
295
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
4.5
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Clc1ccnc2c1cc[nH]2
Complexity: 129
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 1.9
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Clc1ccnc2c1cc[nH]2
Complexity:
129
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
1.9