AE83604
172455-36-6 | 4-Amino-2-chloro-5-nitro-benzonitrile
Manufacturer: A2B Chem
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CatalogNumber
AE83604
ChemicalName
4-Amino-2-chloro-5-nitro-benzonitrile
CasNumber
172455-36-6
MolecularFormula
C7H4ClN3O2
MolecularWeight
197.5786
MdlNumber
MFCD26401904
Smiles
N#Cc1cc([N+](=O)[O-])c(cc1Cl)N
Complexity
256
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
Xlogp3
2
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CatalogNumber: AE83604
ChemicalName: 4-Amino-2-chloro-5-nitro-benzonitrile
CasNumber: 172455-36-6
MolecularFormula: C7H4ClN3O2
MolecularWeight: 197.5786
MdlNumber: MFCD26401904
Smiles: N#Cc1cc([N+](=O)[O-])c(cc1Cl)N
Complexity: 256
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
Xlogp3: 2
CatalogNumber:
AE83604
ChemicalName:
4-Amino-2-chloro-5-nitro-benzonitrile
CasNumber:
172455-36-6
MolecularFormula:
C7H4ClN3O2
MolecularWeight:
197.5786
MdlNumber:
MFCD26401904
Smiles:
N#Cc1cc([N+](=O)[O-])c(cc1Cl)N
Complexity:
256
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
Xlogp3:
2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
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Smiles: C[C@H](Cn1cnc2c1ncnc2N)OCP(=O)(OP(=O)(OP(=O)(O)O)O)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
Xlogp3: __
CatalogNumber:
__
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
C[C@H](Cn1cnc2c1ncnc2N)OCP(=O)(OP(=O)(OP(=O)(O)O)O)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
__
Xlogp3:
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MolecularFormula: __
MolecularWeight: __
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Smiles: COCOc1c(oc2c(c1=O)c(OCC=C(C)C)cc(c2)OCOC)c1ccc(cc1)OCOC
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
__
MdlNumber:
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Smiles:
COCOc1c(oc2c(c1=O)c(OCC=C(C)C)cc(c2)OCOC)c1ccc(cc1)OCOC
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CC(=O)OCc1c2ccccc2cc2c1ccc1c2cccc1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CC(=O)OCc1c2ccccc2cc2c1ccc1c2cccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
Xlogp3:
__