AD52790
143174-02-1 | 3-Amino-4-(ethylamino)benzonitrile
Manufacturer: A2B Chem
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CatalogNumber
AD52790
ChemicalName
3-Amino-4-(ethylamino)benzonitrile
CasNumber
143174-02-1
MolecularFormula
C9H11N3
MolecularWeight
161.2037
MdlNumber
MFCD00643263
Smiles
CCNc1ccc(cc1N)C#N
Complexity
182
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
2
RotatableBondCount
2
Xlogp3
1.3
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CatalogNumber: AD52790
ChemicalName: 3-Amino-4-(ethylamino)benzonitrile
CasNumber: 143174-02-1
MolecularFormula: C9H11N3
MolecularWeight: 161.2037
MdlNumber: MFCD00643263
Smiles: CCNc1ccc(cc1N)C#N
Complexity: 182
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: 2
Xlogp3: 1.3
CatalogNumber:
AD52790
ChemicalName:
3-Amino-4-(ethylamino)benzonitrile
CasNumber:
143174-02-1
MolecularFormula:
C9H11N3
MolecularWeight:
161.2037
MdlNumber:
MFCD00643263
Smiles:
CCNc1ccc(cc1N)C#N
Complexity:
182
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
2
Xlogp3:
1.3
CatalogNumber: __
ChemicalName: __
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MolecularFormula: __
MolecularWeight: __
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Smiles: CCCC=CC(=O)OC(=O)C=CCCC
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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__
ChemicalName:
__
CasNumber:
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MolecularWeight:
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Smiles:
CCCC=CC(=O)OC(=O)C=CCCC
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
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Xlogp3:
__
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MolecularFormula: __
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Smiles: O=C1CCCCN1[C@@H]1c2sc(cc2OC([C@H]1O)(C)C)[N+](=O)[O-]
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
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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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MdlNumber:
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Smiles:
O=C1CCCCN1[C@@H]1c2sc(cc2OC([C@H]1O)(C)C)[N+](=O)[O-]
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
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HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
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Xlogp3:
__
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MolecularFormula: __
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Smiles: BrCc1nc2c(s1)ccc(c2)F
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
BrCc1nc2c(s1)ccc(c2)F
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__