AB75855
46004-37-9 | Methyl 4-amino-2-chlorobenzoate
Manufacturer: A2B Chem
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CatalogNumber
AB75855
ChemicalName
Methyl 4-amino-2-chlorobenzoate
CasNumber
46004-37-9
MolecularFormula
C8H8ClNO2
MolecularWeight
185.6076
MdlNumber
MFCD03840484
Smiles
COC(=O)c1ccc(cc1Cl)N
Complexity
174
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
2.7
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CatalogNumber: AB75855
ChemicalName: Methyl 4-amino-2-chlorobenzoate
CasNumber: 46004-37-9
MolecularFormula: C8H8ClNO2
MolecularWeight: 185.6076
MdlNumber: MFCD03840484
Smiles: COC(=O)c1ccc(cc1Cl)N
Complexity: 174
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 2.7
CatalogNumber:
AB75855
ChemicalName:
Methyl 4-amino-2-chlorobenzoate
CasNumber:
46004-37-9
MolecularFormula:
C8H8ClNO2
MolecularWeight:
185.6076
MdlNumber:
MFCD03840484
Smiles:
COC(=O)c1ccc(cc1Cl)N
Complexity:
174
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
2.7
CatalogNumber: AB75856
ChemicalName: Methyl 4-amino-3-(benzyloxy)-5-bromobenzenecarboxylate
CasNumber: 881909-58-6
MolecularFormula: C15H14BrNO3
MolecularWeight: 336.1806
MdlNumber: MFCD12827830
Smiles: COC(=O)c1cc(OCc2ccccc2)c(c(c1)Br)N
Complexity: 320
Covalently-bondedUnitCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 5
Xlogp3: 3.3
CatalogNumber:
AB75856
ChemicalName:
Methyl 4-amino-3-(benzyloxy)-5-bromobenzenecarboxylate
CasNumber:
881909-58-6
MolecularFormula:
C15H14BrNO3
MolecularWeight:
336.1806
MdlNumber:
MFCD12827830
Smiles:
COC(=O)c1cc(OCc2ccccc2)c(c(c1)Br)N
Complexity:
320
Covalently-bondedUnitCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
5
Xlogp3:
3.3
CatalogNumber: AB75857
ChemicalName: Methyl 4-amino-3-chlorobenzoate
CasNumber: 84228-44-4
MolecularFormula: C8H8ClNO2
MolecularWeight: 185.6076
MdlNumber: MFCD01320686
Smiles: COC(=O)c1ccc(c(c1)Cl)N
Complexity: 174
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 2.7
CatalogNumber:
AB75857
ChemicalName:
Methyl 4-amino-3-chlorobenzoate
CasNumber:
84228-44-4
MolecularFormula:
C8H8ClNO2
MolecularWeight:
185.6076
MdlNumber:
MFCD01320686
Smiles:
COC(=O)c1ccc(c(c1)Cl)N
Complexity:
174
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
2.7
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(=O)c1ccc(c(c1)OC)N
Complexity: 184
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 1.1
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=O)c1ccc(c(c1)OC)N
Complexity:
184
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
1.1