AG64156
619-45-4 | Methyl 4-aminobenzoate
Manufacturer: A2B Chem
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CatalogNumber
AG64156
ChemicalName
Methyl 4-aminobenzoate
CasNumber
619-45-4
MolecularFormula
C8H9NO2
MolecularWeight
151.16256
MdlNumber
MFCD00007891
Smiles
COC(=O)c1ccc(cc1)N
NscNumber
3783
Complexity
139
Covalently-bondedUnitCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
1.4
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CatalogNumber: AG64156
ChemicalName: Methyl 4-aminobenzoate
CasNumber: 619-45-4
MolecularFormula: C8H9NO2
MolecularWeight: 151.16256
MdlNumber: MFCD00007891
Smiles: COC(=O)c1ccc(cc1)N
NscNumber: 3783
Complexity: 139
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 1.4
CatalogNumber:
AG64156
ChemicalName:
Methyl 4-aminobenzoate
CasNumber:
619-45-4
MolecularFormula:
C8H9NO2
MolecularWeight:
151.16256
MdlNumber:
MFCD00007891
Smiles:
COC(=O)c1ccc(cc1)N
NscNumber:
3783
Complexity:
139
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
1.4
CatalogNumber: __
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MolecularFormula: __
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Smiles: COc1cc(CCNCC(COc2cccc(c2)C)O)ccc1OC
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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Smiles:
COc1cc(CCNCC(COc2cccc(c2)C)O)ccc1OC
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Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
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RotatableBondCount:
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Xlogp3:
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Smiles: C1=CCC(CC1)c1ccc(cc1)C1CCCC=C1
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Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
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Xlogp3: __
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
C1=CCC(CC1)c1ccc(cc1)C1CCCC=C1
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Complexity:
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Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
__
Xlogp3:
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Smiles: C1C(O1)CN(CC2CO2)CC3=CC(=CC=C3)CN(CC4CO4)CC5CO5
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
C1C(O1)CN(CC2CO2)CC3=CC(=CC=C3)CN(CC4CO4)CC5CO5
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__