AB49665
193966-70-0 | Methyl 5-(bromomethyl)pyrazine-2-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AB49665
ChemicalName
Methyl 5-(bromomethyl)pyrazine-2-carboxylate
CasNumber
193966-70-0
MolecularFormula
C7H7BrN2O2
MolecularWeight
231.0467
MdlNumber
MFCD16036651
Smiles
COC(=O)c1cnc(cn1)CBr
Complexity
166
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
4
RotatableBondCount
3
Xlogp3
0.4
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CatalogNumber: AB49665
ChemicalName: Methyl 5-(bromomethyl)pyrazine-2-carboxylate
CasNumber: 193966-70-0
MolecularFormula: C7H7BrN2O2
MolecularWeight: 231.0467
MdlNumber: MFCD16036651
Smiles: COC(=O)c1cnc(cn1)CBr
Complexity: 166
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 4
RotatableBondCount: 3
Xlogp3: 0.4
CatalogNumber:
AB49665
ChemicalName:
Methyl 5-(bromomethyl)pyrazine-2-carboxylate
CasNumber:
193966-70-0
MolecularFormula:
C7H7BrN2O2
MolecularWeight:
231.0467
MdlNumber:
MFCD16036651
Smiles:
COC(=O)c1cnc(cn1)CBr
Complexity:
166
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
4
RotatableBondCount:
3
Xlogp3:
0.4
CatalogNumber: AB49666
ChemicalName: 1H-Imidazole-5-acetonitrile
CasNumber: 18502-05-1
MolecularFormula: C5H5N3
MolecularWeight: 107.1133
MdlNumber: MFCD00070306
Smiles: C(c1cnc[nH]1)C#N
Complexity: 112
Covalently-bondedUnitCount: 1
HeavyAtomCount: 8
HydrogenBondAcceptorCount: 2
RotatableBondCount: 1
Xlogp3: -0.2
CatalogNumber:
AB49666
ChemicalName:
1H-Imidazole-5-acetonitrile
CasNumber:
18502-05-1
MolecularFormula:
C5H5N3
MolecularWeight:
107.1133
MdlNumber:
MFCD00070306
Smiles:
C(c1cnc[nH]1)C#N
Complexity:
112
Covalently-bondedUnitCount:
1
HeavyAtomCount:
8
HydrogenBondAcceptorCount:
2
RotatableBondCount:
1
Xlogp3:
-0.2
CatalogNumber: AB49667
ChemicalName: 3-Bromo-2-chloro-6-methylpyridine
CasNumber: 185017-72-5
MolecularFormula: C6H5BrClN
MolecularWeight: 206.4676
MdlNumber: MFCD03095218
Smiles: Cc1ccc(c(n1)Cl)Br
Complexity: 99.1
Covalently-bondedUnitCount: 1
HeavyAtomCount: 9
HydrogenBondAcceptorCount: 1
RotatableBondCount: __
Xlogp3: 2.9
CatalogNumber:
AB49667
ChemicalName:
3-Bromo-2-chloro-6-methylpyridine
CasNumber:
185017-72-5
MolecularFormula:
C6H5BrClN
MolecularWeight:
206.4676
MdlNumber:
MFCD03095218
Smiles:
Cc1ccc(c(n1)Cl)Br
Complexity:
99.1
Covalently-bondedUnitCount:
1
HeavyAtomCount:
9
HydrogenBondAcceptorCount:
1
RotatableBondCount:
__
Xlogp3:
2.9
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(OC)(OC)OC
Complexity: 51.8
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: -0.2
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(OC)(OC)OC
Complexity:
51.8
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
-0.2