AI14595
1222810-74-3 | 2,2'-(Oxybis(methylene))bis(5-nitro-1H-benzo[d]imidazole)
Manufacturer: A2B Chem
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CatalogNumber
AI14595
ChemicalName
2,2'-(Oxybis(methylene))bis(5-nitro-1H-benzo[d]imidazole)
CasNumber
1222810-74-3
MolecularFormula
C16H12N6O5
MolecularWeight
368.3037
MdlNumber
MFCD20264924
Smiles
[O-][N+](=O)c1ccc2c(c1)[nH]c(n2)COCc1nc2c([nH]1)cc(cc2)[N+](=O)[O-]
Complexity
521
Covalently-bondedUnitCount
1
HeavyAtomCount
27
HydrogenBondAcceptorCount
7
HydrogenBondDonorCount
2
RotatableBondCount
4
Xlogp3
1.9
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CatalogNumber: AI14595
ChemicalName: 2,2'-(Oxybis(methylene))bis(5-nitro-1H-benzo[d]imidazole)
CasNumber: 1222810-74-3
MolecularFormula: C16H12N6O5
MolecularWeight: 368.3037
MdlNumber: MFCD20264924
Smiles: [O-][N+](=O)c1ccc2c(c1)[nH]c(n2)COCc1nc2c([nH]1)cc(cc2)[N+](=O)[O-]
Complexity: 521
Covalently-bondedUnitCount: 1
HeavyAtomCount: 27
HydrogenBondAcceptorCount: 7
HydrogenBondDonorCount: 2
RotatableBondCount: 4
Xlogp3: 1.9
CatalogNumber:
AI14595
ChemicalName:
2,2'-(Oxybis(methylene))bis(5-nitro-1H-benzo[d]imidazole)
CasNumber:
1222810-74-3
MolecularFormula:
C16H12N6O5
MolecularWeight:
368.3037
MdlNumber:
MFCD20264924
Smiles:
[O-][N+](=O)c1ccc2c(c1)[nH]c(n2)COCc1nc2c([nH]1)cc(cc2)[N+](=O)[O-]
Complexity:
521
Covalently-bondedUnitCount:
1
HeavyAtomCount:
27
HydrogenBondAcceptorCount:
7
HydrogenBondDonorCount:
2
RotatableBondCount:
4
Xlogp3:
1.9
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Smiles: COC(=O)c1ccc(cc1)c1ccc(c(c1)OC)OC
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Smiles:
COC(=O)c1ccc(cc1)c1ccc(c(c1)OC)OC
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Smiles: OC(=O)c1ccc(cc1)c1cccc(c1)OCc1ccccc1
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Smiles:
OC(=O)c1ccc(cc1)c1cccc(c1)OCc1ccccc1
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Smiles: COc1cc(ccc1c1ccc(c(c1)OC)OC)C(=O)O
Complexity: __
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ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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Smiles:
COc1cc(ccc1c1ccc(c(c1)OC)OC)C(=O)O
Complexity:
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Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
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