AH90691
915416-45-4 | 3',4',5'-Trifluoro-[1,1'-biphenyl]-2-amine
Manufacturer: A2B Chem
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CatalogNumber
AH90691
ChemicalName
3',4',5'-Trifluoro-[1,1'-biphenyl]-2-amine
CasNumber
915416-45-4
MolecularFormula
C12H8F3N
MolecularWeight
223.1938
MdlNumber
MFCD14603436
Smiles
Nc1ccccc1c1cc(F)c(c(c1)F)F
Complexity
224
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
3.1
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CatalogNumber: AH90691
ChemicalName: 3',4',5'-Trifluoro-[1,1'-biphenyl]-2-amine
CasNumber: 915416-45-4
MolecularFormula: C12H8F3N
MolecularWeight: 223.1938
MdlNumber: MFCD14603436
Smiles: Nc1ccccc1c1cc(F)c(c(c1)F)F
Complexity: 224
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 3.1
CatalogNumber:
AH90691
ChemicalName:
3',4',5'-Trifluoro-[1,1'-biphenyl]-2-amine
CasNumber:
915416-45-4
MolecularFormula:
C12H8F3N
MolecularWeight:
223.1938
MdlNumber:
MFCD14603436
Smiles:
Nc1ccccc1c1cc(F)c(c(c1)F)F
Complexity:
224
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
3.1
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Smiles: CCC(=O)c1ccc(cc1)Oc1ccccc1
Complexity: __
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Smiles:
CCC(=O)c1ccc(cc1)Oc1ccccc1
Complexity:
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Smiles: [H+].C[N+](C)(C)CC(=O)[O-].C(C(C(=O)[O-])N)C(=O)[O-].[Na+]
Complexity: __
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Smiles:
[H+].C[N+](C)(C)CC(=O)[O-].C(C(C(=O)[O-])N)C(=O)[O-].[Na+]
Complexity:
__
Covalently-bondedUnitCount:
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RotatableBondCount:
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Smiles: COC(=O)C1CCn2c1c(cc2)C(=O)O
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
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Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
COC(=O)C1CCn2c1c(cc2)C(=O)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
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