AG25157
4518-10-9 | Methyl 3-aminobenzoate
Manufacturer: A2B Chem
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CatalogNumber
AG25157
ChemicalName
Methyl 3-aminobenzoate
CasNumber
4518-10-9
MolecularFormula
C8H9NO2
MolecularWeight
151.16256
MdlNumber
MFCD00017102
Smiles
COC(=O)c1cccc(c1)N
Complexity
147
Covalently-bondedUnitCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
1.5
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CatalogNumber: AG25157
ChemicalName: Methyl 3-aminobenzoate
CasNumber: 4518-10-9
MolecularFormula: C8H9NO2
MolecularWeight: 151.16256
MdlNumber: MFCD00017102
Smiles: COC(=O)c1cccc(c1)N
Complexity: 147
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 1.5
CatalogNumber:
AG25157
ChemicalName:
Methyl 3-aminobenzoate
CasNumber:
4518-10-9
MolecularFormula:
C8H9NO2
MolecularWeight:
151.16256
MdlNumber:
MFCD00017102
Smiles:
COC(=O)c1cccc(c1)N
Complexity:
147
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
1.5
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Brc1cc(C)c(c(c1C)C)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Brc1cc(C)c(c(c1C)C)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AG25159
ChemicalName: 2-Chloro-4-methylthiopyrimidine
CasNumber: 49844-93-1
MolecularFormula: C5H5ClN2S
MolecularWeight: 160.6246
MdlNumber: MFCD09265490
Smiles: CSc1ccnc(n1)Cl
Complexity: 91
Covalently-bondedUnitCount: 1
HeavyAtomCount: 9
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: __
RotatableBondCount: 1
Xlogp3: 2
CatalogNumber:
AG25159
ChemicalName:
2-Chloro-4-methylthiopyrimidine
CasNumber:
49844-93-1
MolecularFormula:
C5H5ClN2S
MolecularWeight:
160.6246
MdlNumber:
MFCD09265490
Smiles:
CSc1ccnc(n1)Cl
Complexity:
91
Covalently-bondedUnitCount:
1
HeavyAtomCount:
9
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
__
RotatableBondCount:
1
Xlogp3:
2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: C1CN(CCN1CCC2=CNC3=CC=CC=C32)C4=CC=CC=C4
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
C1CN(CCN1CCC2=CNC3=CC=CC=C32)C4=CC=CC=C4
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__