AB00440
177952-39-5 | 2,4-Bis(trifluoromethyl)phenylacetic acid
Manufacturer: A2B Chem
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CatalogNumber
AB00440
ChemicalName
2,4-Bis(trifluoromethyl)phenylacetic acid
CasNumber
177952-39-5
MolecularFormula
C10H6F6O2
MolecularWeight
272.1439
MdlNumber
MFCD00042492
Smiles
OC(=O)Cc1ccc(cc1C(F)(F)F)C(F)(F)F
Complexity
309
Covalently-bondedUnitCount
1
HeavyAtomCount
18
HydrogenBondAcceptorCount
8
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
3.2
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CatalogNumber: AB00440
ChemicalName: 2,4-Bis(trifluoromethyl)phenylacetic acid
CasNumber: 177952-39-5
MolecularFormula: C10H6F6O2
MolecularWeight: 272.1439
MdlNumber: MFCD00042492
Smiles: OC(=O)Cc1ccc(cc1C(F)(F)F)C(F)(F)F
Complexity: 309
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 8
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 3.2
CatalogNumber:
AB00440
ChemicalName:
2,4-Bis(trifluoromethyl)phenylacetic acid
CasNumber:
177952-39-5
MolecularFormula:
C10H6F6O2
MolecularWeight:
272.1439
MdlNumber:
MFCD00042492
Smiles:
OC(=O)Cc1ccc(cc1C(F)(F)F)C(F)(F)F
Complexity:
309
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
8
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
3.2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
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Smiles: N#Cc1ccc(cc1C(F)(F)F)C(F)(F)F
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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__
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MolecularWeight:
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MdlNumber:
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Smiles:
N#Cc1ccc(cc1C(F)(F)F)C(F)(F)F
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
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RotatableBondCount:
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ChemicalName: __
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MolecularFormula: __
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Smiles: CC(=O)OCCB1OC(C(O1)(C)C)(C)C
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
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Xlogp3: __
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
CC(=O)OCCB1OC(C(O1)(C)C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
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Smiles: O=C1N(SC2CCCCC2)C(=O)c2c1cccc2
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C1N(SC2CCCCC2)C(=O)c2c1cccc2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__