AA94462
17556-19-3 | 7-Chloro-2-tetralone
Manufacturer: A2B Chem
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CatalogNumber
AA94462
ChemicalName
7-Chloro-2-tetralone
CasNumber
17556-19-3
MolecularFormula
C10H9ClO
MolecularWeight
180.6309
MdlNumber
MFCD04038575
Smiles
Clc1cc2CC(=O)CCc2cc1
Complexity
190
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
1
Xlogp3
2.2
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CatalogNumber: AA94462
ChemicalName: 7-Chloro-2-tetralone
CasNumber: 17556-19-3
MolecularFormula: C10H9ClO
MolecularWeight: 180.6309
MdlNumber: MFCD04038575
Smiles: Clc1cc2CC(=O)CCc2cc1
Complexity: 190
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 1
Xlogp3: 2.2
CatalogNumber:
AA94462
ChemicalName:
7-Chloro-2-tetralone
CasNumber:
17556-19-3
MolecularFormula:
C10H9ClO
MolecularWeight:
180.6309
MdlNumber:
MFCD04038575
Smiles:
Clc1cc2CC(=O)CCc2cc1
Complexity:
190
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
1
Xlogp3:
2.2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C1CCc2c(C1)ccc(c2)Cl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C1CCc2c(C1)ccc(c2)Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COc1ccc(cc1)C[C@@H](C(=O)O)NC(=O)OCc1ccccc1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COc1ccc(cc1)C[C@@H](C(=O)O)NC(=O)OCc1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
Xlogp3:
__
CatalogNumber: AA94467
ChemicalName: Methyl 4-cyano-2-fluorobenzoate
CasNumber: 175596-01-7
MolecularFormula: C9H6FNO2
MolecularWeight: 179.1478
MdlNumber: MFCD04335187
Smiles: COC(=O)c1ccc(cc1F)C#N
Complexity: 245
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 4
Xlogp3: 1.5
CatalogNumber:
AA94467
ChemicalName:
Methyl 4-cyano-2-fluorobenzoate
CasNumber:
175596-01-7
MolecularFormula:
C9H6FNO2
MolecularWeight:
179.1478
MdlNumber:
MFCD04335187
Smiles:
COC(=O)c1ccc(cc1F)C#N
Complexity:
245
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
4
Xlogp3:
1.5