AI13038
120511-74-2 | 5-Methyl-1,3-benzenediacetonitrile
Manufacturer: A2B Chem
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CatalogNumber
AI13038
ChemicalName
5-Methyl-1,3-benzenediacetonitrile
CasNumber
120511-74-2
MolecularFormula
C6H7ClN2O2
MolecularWeight
174.585
MdlNumber
MFCD07782113
Smiles
OCCc1c(Cl)cn[nH]c1=O
Complexity
226
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
2
RotatableBondCount
2
Xlogp3
1.6
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CatalogNumber: AI13038
ChemicalName: 5-Methyl-1,3-benzenediacetonitrile
CasNumber: 120511-74-2
MolecularFormula: C6H7ClN2O2
MolecularWeight: 174.585
MdlNumber: MFCD07782113
Smiles: OCCc1c(Cl)cn[nH]c1=O
Complexity: 226
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 2
RotatableBondCount: 2
Xlogp3: 1.6
CatalogNumber:
AI13038
ChemicalName:
5-Methyl-1,3-benzenediacetonitrile
CasNumber:
120511-74-2
MolecularFormula:
C6H7ClN2O2
MolecularWeight:
174.585
MdlNumber:
MFCD07782113
Smiles:
OCCc1c(Cl)cn[nH]c1=O
Complexity:
226
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
2
RotatableBondCount:
2
Xlogp3:
1.6
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Smiles: N#CC(c1cc(cc(c1)C(C#N)(C)C)Cn1cnnc1)(C)C
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
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Smiles:
N#CC(c1cc(cc(c1)C(C#N)(C)C)Cn1cnnc1)(C)C
Complexity:
__
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Smiles: O=C(NC(=O)OC(C)(C)C)OCc1ccccc1
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Smiles:
O=C(NC(=O)OC(C)(C)C)OCc1ccccc1
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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RotatableBondCount:
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Smiles: [Mn]#[As]
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CatalogNumber:
__
ChemicalName:
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CasNumber:
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MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
[Mn]#[As]
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__