AI52175
5428-05-7 | Ethyl 2-[(2-nitrophenyl)amino]acetate
Manufacturer: A2B Chem
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CatalogNumber
AI52175
ChemicalName
Ethyl 2-[(2-nitrophenyl)amino]acetate
CasNumber
5428-05-7
MolecularFormula
C10H12N2O4
MolecularWeight
224.2133
MdlNumber
MFCD00455119
Smiles
CCOC(=O)CNc1ccccc1[N+](=O)[O-]
NscNumber
12797
Complexity
252
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
1
RotatableBondCount
5
Xlogp3
2.5
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CatalogNumber: AI52175
ChemicalName: Ethyl 2-[(2-nitrophenyl)amino]acetate
CasNumber: 5428-05-7
MolecularFormula: C10H12N2O4
MolecularWeight: 224.2133
MdlNumber: MFCD00455119
Smiles: CCOC(=O)CNc1ccccc1[N+](=O)[O-]
NscNumber: 12797
Complexity: 252
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 5
Xlogp3: 2.5
CatalogNumber:
AI52175
ChemicalName:
Ethyl 2-[(2-nitrophenyl)amino]acetate
CasNumber:
5428-05-7
MolecularFormula:
C10H12N2O4
MolecularWeight:
224.2133
MdlNumber:
MFCD00455119
Smiles:
CCOC(=O)CNc1ccccc1[N+](=O)[O-]
NscNumber:
12797
Complexity:
252
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
5
Xlogp3:
2.5
CatalogNumber: AI52176
ChemicalName: 2-Methyl-5-nitrophenol
CasNumber: 5428-54-6
MolecularFormula: C7H7NO3
MolecularWeight: 153.1354
MdlNumber: MFCD00043909
Smiles: [O-][N+](=O)c1ccc(c(c1)O)C
NscNumber: __
Complexity: 154
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: __
Xlogp3: 1.8
CatalogNumber:
AI52176
ChemicalName:
2-Methyl-5-nitrophenol
CasNumber:
5428-54-6
MolecularFormula:
C7H7NO3
MolecularWeight:
153.1354
MdlNumber:
MFCD00043909
Smiles:
[O-][N+](=O)c1ccc(c(c1)O)C
NscNumber:
__
Complexity:
154
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
__
Xlogp3:
1.8
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CN1CCC(CC1)Br.Br
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CN1CCC(CC1)Br.Br
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)C1CCc2c(C1)c(=O)[nH]c(n2)N
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)C1CCc2c(C1)c(=O)[nH]c(n2)N
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__