AA88430
16588-02-6 | 2-Chloro-5-nitrobenzonitrile
Manufacturer: A2B Chem
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CatalogNumber
AA88430
ChemicalName
2-Chloro-5-nitrobenzonitrile
CasNumber
16588-02-6
MolecularFormula
C7H3ClN2O2
MolecularWeight
182.56392
MdlNumber
MFCD00007292
Smiles
N#Cc1cc(ccc1Cl)[N+](=O)[O-]
NscNumber
28973
Complexity
229
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
3
Xlogp3
2.2
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CatalogNumber: AA88430
ChemicalName: 2-Chloro-5-nitrobenzonitrile
CasNumber: 16588-02-6
MolecularFormula: C7H3ClN2O2
MolecularWeight: 182.56392
MdlNumber: MFCD00007292
Smiles: N#Cc1cc(ccc1Cl)[N+](=O)[O-]
NscNumber: 28973
Complexity: 229
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 3
Xlogp3: 2.2
CatalogNumber:
AA88430
ChemicalName:
2-Chloro-5-nitrobenzonitrile
CasNumber:
16588-02-6
MolecularFormula:
C7H3ClN2O2
MolecularWeight:
182.56392
MdlNumber:
MFCD00007292
Smiles:
N#Cc1cc(ccc1Cl)[N+](=O)[O-]
NscNumber:
28973
Complexity:
229
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
3
Xlogp3:
2.2
CatalogNumber: AA88431
ChemicalName: 4-tert-Amylcyclohexanone
CasNumber: 16587-71-6
MolecularFormula: C11H20O
MolecularWeight: 168.2759
MdlNumber: MFCD00013798
Smiles: CCC(C1CCC(=O)CC1)(C)C
NscNumber: 21167
Complexity: 160
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 1
Xlogp3: 2.9
CatalogNumber:
AA88431
ChemicalName:
4-tert-Amylcyclohexanone
CasNumber:
16587-71-6
MolecularFormula:
C11H20O
MolecularWeight:
168.2759
MdlNumber:
MFCD00013798
Smiles:
CCC(C1CCC(=O)CC1)(C)C
NscNumber:
21167
Complexity:
160
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
1
Xlogp3:
2.9
CatalogNumber: __
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Smiles: Cc1cc(C)c2c(c1)cc(s2)C
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Smiles:
Cc1cc(C)c2c(c1)cc(s2)C
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Smiles: Cc1ccc2c(c1)sc1c2cccc1
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MolecularWeight:
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Smiles:
Cc1ccc2c(c1)sc1c2cccc1
NscNumber:
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Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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Xlogp3:
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