AD86688
886365-06-6 | 5-Bromo-4-methyl-pyridine-2-carboxylic acid methyl ester
Manufacturer: A2B Chem
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CatalogNumber
AD86688
ChemicalName
5-Bromo-4-methyl-pyridine-2-carboxylic acid methyl ester
CasNumber
886365-06-6
MolecularFormula
C8H8BrNO2
MolecularWeight
230.05862000000002
MdlNumber
MFCD07375102
Smiles
Cc1cc(ncc1Br)C(=O)OC
Complexity
174
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
3
RotatableBondCount
2
Xlogp3
2.1
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CatalogNumber: AD86688
ChemicalName: 5-Bromo-4-methyl-pyridine-2-carboxylic acid methyl ester
CasNumber: 886365-06-6
MolecularFormula: C8H8BrNO2
MolecularWeight: 230.05862000000002
MdlNumber: MFCD07375102
Smiles: Cc1cc(ncc1Br)C(=O)OC
Complexity: 174
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 3
RotatableBondCount: 2
Xlogp3: 2.1
CatalogNumber:
AD86688
ChemicalName:
5-Bromo-4-methyl-pyridine-2-carboxylic acid methyl ester
CasNumber:
886365-06-6
MolecularFormula:
C8H8BrNO2
MolecularWeight:
230.05862000000002
MdlNumber:
MFCD07375102
Smiles:
Cc1cc(ncc1Br)C(=O)OC
Complexity:
174
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
3
RotatableBondCount:
2
Xlogp3:
2.1
CatalogNumber: AD86689
ChemicalName: 5-Bromo-4-methylpicolinaldehyde
CasNumber: 886364-94-9
MolecularFormula: C7H6BrNO
MolecularWeight: 200.0326
MdlNumber: MFCD07375095
Smiles: O=Cc1ncc(c(c1)C)Br
Complexity: 129
Covalently-bondedUnitCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 2
RotatableBondCount: 1
Xlogp3: 1.7
CatalogNumber:
AD86689
ChemicalName:
5-Bromo-4-methylpicolinaldehyde
CasNumber:
886364-94-9
MolecularFormula:
C7H6BrNO
MolecularWeight:
200.0326
MdlNumber:
MFCD07375095
Smiles:
O=Cc1ncc(c(c1)C)Br
Complexity:
129
Covalently-bondedUnitCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
2
RotatableBondCount:
1
Xlogp3:
1.7
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Smiles: COc1cccc2c1CC(CC2)(C(=O)O)N(C(=O)OC(C)(C)C)C
Complexity: __
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Smiles:
COc1cccc2c1CC(CC2)(C(=O)O)N(C(=O)OC(C)(C)C)C
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Smiles: O=C(OC(C)(C)C)NCC(C(=O)O)Cc1cccc(c1)Br
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MolecularFormula:
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Smiles:
O=C(OC(C)(C)C)NCC(C(=O)O)Cc1cccc(c1)Br
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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Xlogp3:
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