AB46532
78686-77-8 | Methyl 5-bromo-6-chloronicotinate
Manufacturer: A2B Chem
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CatalogNumber
AB46532
ChemicalName
Methyl 5-bromo-6-chloronicotinate
CasNumber
78686-77-8
MolecularFormula
C7H5BrClNO2
MolecularWeight
250.4771
MdlNumber
MFCD03844855
Smiles
COC(=O)c1cnc(c(c1)Br)Cl
Complexity
179
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
3
RotatableBondCount
2
Xlogp3
2.4
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CatalogNumber: AB46532
ChemicalName: Methyl 5-bromo-6-chloronicotinate
CasNumber: 78686-77-8
MolecularFormula: C7H5BrClNO2
MolecularWeight: 250.4771
MdlNumber: MFCD03844855
Smiles: COC(=O)c1cnc(c(c1)Br)Cl
Complexity: 179
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 3
RotatableBondCount: 2
Xlogp3: 2.4
CatalogNumber:
AB46532
ChemicalName:
Methyl 5-bromo-6-chloronicotinate
CasNumber:
78686-77-8
MolecularFormula:
C7H5BrClNO2
MolecularWeight:
250.4771
MdlNumber:
MFCD03844855
Smiles:
COC(=O)c1cnc(c(c1)Br)Cl
Complexity:
179
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
3
RotatableBondCount:
2
Xlogp3:
2.4
CatalogNumber: AB46533
ChemicalName: Methyl 5-bromopyrimidine-2-carboxylate
CasNumber: 89581-38-4
MolecularFormula: C6H5BrN2O2
MolecularWeight: 217.0201
MdlNumber: MFCD11111606
Smiles: COC(=O)c1ncc(cn1)Br
Complexity: 146
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 4
RotatableBondCount: 2
Xlogp3: __
CatalogNumber:
AB46533
ChemicalName:
Methyl 5-bromopyrimidine-2-carboxylate
CasNumber:
89581-38-4
MolecularFormula:
C6H5BrN2O2
MolecularWeight:
217.0201
MdlNumber:
MFCD11111606
Smiles:
COC(=O)c1ncc(cn1)Br
Complexity:
146
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
4
RotatableBondCount:
2
Xlogp3:
__
CatalogNumber: AB46534
ChemicalName: Methyl 5-bromovalerate
CasNumber: 5454-83-1
MolecularFormula: C6H11BrO2
MolecularWeight: 195.0543
MdlNumber: MFCD00000265
Smiles: BrCCCCC(=O)OC
Complexity: 83.1
Covalently-bondedUnitCount: 1
HeavyAtomCount: 9
HydrogenBondAcceptorCount: 2
RotatableBondCount: 5
Xlogp3: 1.9
CatalogNumber:
AB46534
ChemicalName:
Methyl 5-bromovalerate
CasNumber:
5454-83-1
MolecularFormula:
C6H11BrO2
MolecularWeight:
195.0543
MdlNumber:
MFCD00000265
Smiles:
BrCCCCC(=O)OC
Complexity:
83.1
Covalently-bondedUnitCount:
1
HeavyAtomCount:
9
HydrogenBondAcceptorCount:
2
RotatableBondCount:
5
Xlogp3:
1.9
CatalogNumber: AB46535
ChemicalName: Methyl 5-chloro-2-nitrobenzoate
CasNumber: 51282-49-6
MolecularFormula: C8H6ClNO4
MolecularWeight: 215.5905
MdlNumber: MFCD19313154
Smiles: [O-][N+](=O)c1ccc(cc1C(=O)OC)Cl
Complexity: 240
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 4
RotatableBondCount: 2
Xlogp3: 2.5
CatalogNumber:
AB46535
ChemicalName:
Methyl 5-chloro-2-nitrobenzoate
CasNumber:
51282-49-6
MolecularFormula:
C8H6ClNO4
MolecularWeight:
215.5905
MdlNumber:
MFCD19313154
Smiles:
[O-][N+](=O)c1ccc(cc1C(=O)OC)Cl
Complexity:
240
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
4
RotatableBondCount:
2
Xlogp3:
2.5