AI49350
3816-62-4 | Methyl 2-amino-5-nitrobenzoate
Manufacturer: A2B Chem
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CatalogNumber
AI49350
ChemicalName
Methyl 2-amino-5-nitrobenzoate
CasNumber
3816-62-4
MolecularFormula
C8H8N2O4
MolecularWeight
196.16012
MdlNumber
MFCD00278157
Smiles
COC(=O)c1cc(ccc1N)[N+](=O)[O-]
Complexity
238
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
2.5
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CatalogNumber: AI49350
ChemicalName: Methyl 2-amino-5-nitrobenzoate
CasNumber: 3816-62-4
MolecularFormula: C8H8N2O4
MolecularWeight: 196.16012
MdlNumber: MFCD00278157
Smiles: COC(=O)c1cc(ccc1N)[N+](=O)[O-]
Complexity: 238
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 2.5
CatalogNumber:
AI49350
ChemicalName:
Methyl 2-amino-5-nitrobenzoate
CasNumber:
3816-62-4
MolecularFormula:
C8H8N2O4
MolecularWeight:
196.16012
MdlNumber:
MFCD00278157
Smiles:
COC(=O)c1cc(ccc1N)[N+](=O)[O-]
Complexity:
238
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
2.5
CatalogNumber: __
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MolecularFormula: __
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Smiles: O=Cc1c(O)cccc1I
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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MolecularFormula:
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Smiles:
O=Cc1c(O)cccc1I
Complexity:
__
Covalently-bondedUnitCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
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RotatableBondCount:
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Smiles: N1CCN(CC1)CCn1cncc1
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Smiles:
N1CCN(CC1)CCn1cncc1
Complexity:
__
Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
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Xlogp3:
__
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Smiles: COc1cccc(c1)C1CNCC1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
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MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
COc1cccc(c1)C1CNCC1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__