AB38596
29681-44-5 | Methyl 5-bromonicotinate
Manufacturer: A2B Chem
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CatalogNumber
AB38596
ChemicalName
Methyl 5-bromonicotinate
CasNumber
29681-44-5
MolecularFormula
C7H6BrNO2
MolecularWeight
216.032
MdlNumber
MFCD00173668
Smiles
COC(=O)c1cncc(c1)Br
Complexity
151
Covalently-bondedUnitCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
3
RotatableBondCount
2
Xlogp3
1.4
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CatalogNumber: AB38596
ChemicalName: Methyl 5-bromonicotinate
CasNumber: 29681-44-5
MolecularFormula: C7H6BrNO2
MolecularWeight: 216.032
MdlNumber: MFCD00173668
Smiles: COC(=O)c1cncc(c1)Br
Complexity: 151
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 3
RotatableBondCount: 2
Xlogp3: 1.4
CatalogNumber:
AB38596
ChemicalName:
Methyl 5-bromonicotinate
CasNumber:
29681-44-5
MolecularFormula:
C7H6BrNO2
MolecularWeight:
216.032
MdlNumber:
MFCD00173668
Smiles:
COC(=O)c1cncc(c1)Br
Complexity:
151
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
3
RotatableBondCount:
2
Xlogp3:
1.4
CatalogNumber: AB38597
ChemicalName: Methyl 4-methoxypicolinate
CasNumber: 29681-43-4
MolecularFormula: C8H9NO3
MolecularWeight: 167.162
MdlNumber: MFCD00956223
Smiles: COc1ccnc(c1)C(=O)OC
Complexity: 160
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 4
RotatableBondCount: 3
Xlogp3: 1
CatalogNumber:
AB38597
ChemicalName:
Methyl 4-methoxypicolinate
CasNumber:
29681-43-4
MolecularFormula:
C8H9NO3
MolecularWeight:
167.162
MdlNumber:
MFCD00956223
Smiles:
COc1ccnc(c1)C(=O)OC
Complexity:
160
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
4
RotatableBondCount:
3
Xlogp3:
1
CatalogNumber: AB38598
ChemicalName: Methyl 4-bromopicolinate
CasNumber: 29681-42-3
MolecularFormula: C7H6BrNO2
MolecularWeight: 216.032
MdlNumber: MFCD07374897
Smiles: COC(=O)c1cc(Br)ccn1
Complexity: 151
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 3
RotatableBondCount: 2
Xlogp3: 1.7
CatalogNumber:
AB38598
ChemicalName:
Methyl 4-bromopicolinate
CasNumber:
29681-42-3
MolecularFormula:
C7H6BrNO2
MolecularWeight:
216.032
MdlNumber:
MFCD07374897
Smiles:
COC(=O)c1cc(Br)ccn1
Complexity:
151
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
3
RotatableBondCount:
2
Xlogp3:
1.7
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Smiles: [O-][N+](=O)c1cc(ncc1)C(=O)OC
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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MdlNumber:
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Smiles:
[O-][N+](=O)c1cc(ncc1)C(=O)OC
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
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Xlogp3:
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