AG76628
634187-08-9 | 2-Methoxy-3-(trifluoromethyl)aniline
Manufacturer: A2B Chem
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CatalogNumber
AG76628
ChemicalName
2-Methoxy-3-(trifluoromethyl)aniline
CasNumber
634187-08-9
MolecularFormula
C8H8F3NO
MolecularWeight
191.1504
MdlNumber
MFCD08532489
Smiles
COc1c(N)cccc1C(F)(F)F
Complexity
171
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
2.1
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CatalogNumber: AG76628
ChemicalName: 2-Methoxy-3-(trifluoromethyl)aniline
CasNumber: 634187-08-9
MolecularFormula: C8H8F3NO
MolecularWeight: 191.1504
MdlNumber: MFCD08532489
Smiles: COc1c(N)cccc1C(F)(F)F
Complexity: 171
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 2.1
CatalogNumber:
AG76628
ChemicalName:
2-Methoxy-3-(trifluoromethyl)aniline
CasNumber:
634187-08-9
MolecularFormula:
C8H8F3NO
MolecularWeight:
191.1504
MdlNumber:
MFCD08532489
Smiles:
COc1c(N)cccc1C(F)(F)F
Complexity:
171
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
2.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCCCCCCCCC(=O)CC(=O)NC1CCCCC1=O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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Smiles:
CCCCCCCCCC(=O)CC(=O)NC1CCCCC1=O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
__
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ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Brc1ccc(cc1)c1cc(nc(n1)c1ccccc1)c1ccccc1
Complexity: 395
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 5.9
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:
Brc1ccc(cc1)c1cc(nc(n1)c1ccccc1)c1ccccc1
Complexity:
395
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
5.9
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MolecularFormula: __
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MdlNumber: __
Smiles: CC1=CC(=C(O1)C)SC
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
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MolecularFormula:
__
MolecularWeight:
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MdlNumber:
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Smiles:
CC1=CC(=C(O1)C)SC
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__