AG65522
56456-51-0 | 2-Chloro-4-(trifluoromethyl)benzylalcohol
Manufacturer: A2B Chem
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CatalogNumber
AG65522
ChemicalName
2-Chloro-4-(trifluoromethyl)benzylalcohol
CasNumber
56456-51-0
MolecularFormula
C8H6ClF3O
MolecularWeight
210.5808
MdlNumber
MFCD04972757
Smiles
OCc1ccc(cc1Cl)C(F)(F)F
Complexity
171
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
2.5
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CatalogNumber: AG65522
ChemicalName: 2-Chloro-4-(trifluoromethyl)benzylalcohol
CasNumber: 56456-51-0
MolecularFormula: C8H6ClF3O
MolecularWeight: 210.5808
MdlNumber: MFCD04972757
Smiles: OCc1ccc(cc1Cl)C(F)(F)F
Complexity: 171
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 2.5
CatalogNumber:
AG65522
ChemicalName:
2-Chloro-4-(trifluoromethyl)benzylalcohol
CasNumber:
56456-51-0
MolecularFormula:
C8H6ClF3O
MolecularWeight:
210.5808
MdlNumber:
MFCD04972757
Smiles:
OCc1ccc(cc1Cl)C(F)(F)F
Complexity:
171
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
2.5
CatalogNumber: __
ChemicalName: __
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MolecularFormula: __
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Smiles: Nc1cccc2c1CCO2
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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Smiles:
Nc1cccc2c1CCO2
Complexity:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Smiles: OCC1OC(OC2C(O)C(OC(C2O)C)OC2CCC3(C(C2(C)CO)CCC2(C3C=CC3=C4CC(C)(C)CCC4(C(CC23C)O)CO)C)C)C(C(C1O)O)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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Smiles:
OCC1OC(OC2C(O)C(OC(C2O)C)OC2CCC3(C(C2(C)CO)CCC2(C3C=CC3=C4CC(C)(C)CCC4(C(CC23C)O)CO)C)C)C(C(C1O)O)O
Complexity:
__
Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
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RotatableBondCount:
__
Xlogp3:
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Smiles: O=C1C=CC[C@H]2N1C[C@@H]1CCCN3[C@@H]1[C@@H]2CCC3
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
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ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
__
MdlNumber:
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Smiles:
O=C1C=CC[C@H]2N1C[C@@H]1CCCN3[C@@H]1[C@@H]2CCC3
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__