AB34721
28694-94-2 | Methyl 2-(4-amino-3-nitrophenyl)acetate
Manufacturer: A2B Chem
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CatalogNumber
AB34721
ChemicalName
Methyl 2-(4-amino-3-nitrophenyl)acetate
CasNumber
28694-94-2
MolecularFormula
C9H10N2O4
MolecularWeight
210.1867
MdlNumber
MFCD16620323
Smiles
COC(=O)Cc1ccc(c(c1)[N+](=O)[O-])N
Complexity
251
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
1.4
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CatalogNumber: AB34721
ChemicalName: Methyl 2-(4-amino-3-nitrophenyl)acetate
CasNumber: 28694-94-2
MolecularFormula: C9H10N2O4
MolecularWeight: 210.1867
MdlNumber: MFCD16620323
Smiles: COC(=O)Cc1ccc(c(c1)[N+](=O)[O-])N
Complexity: 251
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 1.4
CatalogNumber:
AB34721
ChemicalName:
Methyl 2-(4-amino-3-nitrophenyl)acetate
CasNumber:
28694-94-2
MolecularFormula:
C9H10N2O4
MolecularWeight:
210.1867
MdlNumber:
MFCD16620323
Smiles:
COC(=O)Cc1ccc(c(c1)[N+](=O)[O-])N
Complexity:
251
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
1.4
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MolecularFormula: __
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Smiles: CC(c1ccc(cc1)N)C#N
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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Smiles:
CC(c1ccc(cc1)N)C#N
Complexity:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Smiles: C1CCCNC1.CCCCCCCCCCCC(=O)O
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Smiles:
C1CCCNC1.CCCCCCCCCCCC(=O)O
Complexity:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Smiles: COc1ccc2c(c1)C(=NC2=N)N
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COc1ccc2c(c1)C(=NC2=N)N
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__