AA89969
167762-80-3 | 4-(2-Aminoethyl)benzonitrile, HCl
Manufacturer: A2B Chem
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CatalogNumber
AA89969
ChemicalName
4-(2-Aminoethyl)benzonitrile, HCl
CasNumber
167762-80-3
MolecularFormula
C9H11ClN2
MolecularWeight
182.65
MdlNumber
MFCD09878803
Smiles
NCCc1ccc(cc1)C#N.Cl
Complexity
148
Covalently-bondedUnitCount
2
HeavyAtomCount
12
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
2
RotatableBondCount
2
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CatalogNumber: AA89969
ChemicalName: 4-(2-Aminoethyl)benzonitrile, HCl
CasNumber: 167762-80-3
MolecularFormula: C9H11ClN2
MolecularWeight: 182.65
MdlNumber: MFCD09878803
Smiles: NCCc1ccc(cc1)C#N.Cl
Complexity: 148
Covalently-bondedUnitCount: 2
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 2
RotatableBondCount: 2
CatalogNumber:
AA89969
ChemicalName:
4-(2-Aminoethyl)benzonitrile, HCl
CasNumber:
167762-80-3
MolecularFormula:
C9H11ClN2
MolecularWeight:
182.65
MdlNumber:
MFCD09878803
Smiles:
NCCc1ccc(cc1)C#N.Cl
Complexity:
148
Covalently-bondedUnitCount:
2
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
2
RotatableBondCount:
2
CatalogNumber: AA89970
ChemicalName: Methyl 4-amino-3-(trifluoromethyl)benzoate
CasNumber: 167760-75-0
MolecularFormula: C9H8F3NO2
MolecularWeight: 219.1605
MdlNumber: MFCD11226326
Smiles: COC(=O)c1ccc(c(c1)C(F)(F)F)N
Complexity: 242
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 1
RotatableBondCount: 2
CatalogNumber:
AA89970
ChemicalName:
Methyl 4-amino-3-(trifluoromethyl)benzoate
CasNumber:
167760-75-0
MolecularFormula:
C9H8F3NO2
MolecularWeight:
219.1605
MdlNumber:
MFCD11226326
Smiles:
COC(=O)c1ccc(c(c1)C(F)(F)F)N
Complexity:
242
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
1
RotatableBondCount:
2
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Smiles: CCC(C(=O)c1ccc(cc1)C)(C)C
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Smiles:
CCC(C(=O)c1ccc(cc1)C)(C)C
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Smiles: CCOC(=O)c1ccc(cc1C(F)(F)F)F
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ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
CCOC(=O)c1ccc(cc1C(F)(F)F)F
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
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