AB46454
57113-91-4 | Methyl 2-amino-3-nitrobenzoate
Manufacturer: A2B Chem
The price for this product is unavailable. Please request a quote
CatalogNumber
AB46454
ChemicalName
Methyl 2-amino-3-nitrobenzoate
CasNumber
57113-91-4
MolecularFormula
C8H8N2O4
MolecularWeight
196.1601
MdlNumber
MFCD02093531
Smiles
COC(=O)c1cccc(c1N)[N+](=O)[O-]
Complexity
238
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
1.5
Related Products
Compare Similar Items
Show Difference
CatalogNumber: AB46454
ChemicalName: Methyl 2-amino-3-nitrobenzoate
CasNumber: 57113-91-4
MolecularFormula: C8H8N2O4
MolecularWeight: 196.1601
MdlNumber: MFCD02093531
Smiles: COC(=O)c1cccc(c1N)[N+](=O)[O-]
Complexity: 238
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 1.5
CatalogNumber:
AB46454
ChemicalName:
Methyl 2-amino-3-nitrobenzoate
CasNumber:
57113-91-4
MolecularFormula:
C8H8N2O4
MolecularWeight:
196.1601
MdlNumber:
MFCD02093531
Smiles:
COC(=O)c1cccc(c1N)[N+](=O)[O-]
Complexity:
238
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
1.5
CatalogNumber: AB46455
ChemicalName: Methyl 2-aminoisonicotinate
CasNumber: 6937-03-7
MolecularFormula: C7H8N2O2
MolecularWeight: 152.15062
MdlNumber: MFCD04039316
Smiles: COC(=O)c1ccnc(c1)N
Complexity: 149
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 0.3
CatalogNumber:
AB46455
ChemicalName:
Methyl 2-aminoisonicotinate
CasNumber:
6937-03-7
MolecularFormula:
C7H8N2O2
MolecularWeight:
152.15062
MdlNumber:
MFCD04039316
Smiles:
COC(=O)c1ccnc(c1)N
Complexity:
149
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
0.3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(=O)c1ccsc1N
Complexity: 140
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 1.7
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=O)c1ccsc1N
Complexity:
140
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
1.7
CatalogNumber: AB46457
ChemicalName: Methyl 2-bromo-4-fluorobenzoate
CasNumber: 653-92-9
MolecularFormula: C8H6BrFO2
MolecularWeight: 233.0344
MdlNumber: MFCD06204026
Smiles: COC(=O)c1ccc(cc1Br)F
Complexity: 174
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: __
RotatableBondCount: 2
Xlogp3: 3.6
CatalogNumber:
AB46457
ChemicalName:
Methyl 2-bromo-4-fluorobenzoate
CasNumber:
653-92-9
MolecularFormula:
C8H6BrFO2
MolecularWeight:
233.0344
MdlNumber:
MFCD06204026
Smiles:
COC(=O)c1ccc(cc1Br)F
Complexity:
174
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
__
RotatableBondCount:
2
Xlogp3:
3.6