AB46481
369-25-5 | Methyl 3,4-difluorobenzoate
Manufacturer: A2B Chem
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CatalogNumber
AB46481
ChemicalName
Methyl 3,4-difluorobenzoate
CasNumber
369-25-5
MolecularFormula
C8H6F2O2
MolecularWeight
172.1288
MdlNumber
MFCD00276597
Smiles
COC(=O)c1ccc(c(c1)F)F
Complexity
172
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
4
RotatableBondCount
2
Xlogp3
2.2
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CatalogNumber: AB46481
ChemicalName: Methyl 3,4-difluorobenzoate
CasNumber: 369-25-5
MolecularFormula: C8H6F2O2
MolecularWeight: 172.1288
MdlNumber: MFCD00276597
Smiles: COC(=O)c1ccc(c(c1)F)F
Complexity: 172
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 4
RotatableBondCount: 2
Xlogp3: 2.2
CatalogNumber:
AB46481
ChemicalName:
Methyl 3,4-difluorobenzoate
CasNumber:
369-25-5
MolecularFormula:
C8H6F2O2
MolecularWeight:
172.1288
MdlNumber:
MFCD00276597
Smiles:
COC(=O)c1ccc(c(c1)F)F
Complexity:
172
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
4
RotatableBondCount:
2
Xlogp3:
2.2
CatalogNumber: AB46482
ChemicalName: Methyl 3,5-dibromo-4-methylbenzoate
CasNumber: 74896-66-5
MolecularFormula: C9H8Br2O2
MolecularWeight: 307.9666
MdlNumber: MFCD00010729
Smiles: COC(=O)c1cc(Br)c(c(c1)Br)C
Complexity: 184
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 2
RotatableBondCount: 2
Xlogp3: 3.5
CatalogNumber:
AB46482
ChemicalName:
Methyl 3,5-dibromo-4-methylbenzoate
CasNumber:
74896-66-5
MolecularFormula:
C9H8Br2O2
MolecularWeight:
307.9666
MdlNumber:
MFCD00010729
Smiles:
COC(=O)c1cc(Br)c(c(c1)Br)C
Complexity:
184
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
2
RotatableBondCount:
2
Xlogp3:
3.5
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(=O)c1sccc1N
Complexity: 140
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 1.7
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=O)c1sccc1N
Complexity:
140
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
1.7
CatalogNumber: AB46484
ChemicalName: Methyl 3-amino-6-bromopyrazine-2-carboxylate
CasNumber: 6966-01-4
MolecularFormula: C6H6BrN3O2
MolecularWeight: 232.03473999999994
MdlNumber: MFCD04038568
Smiles: COC(=O)c1nc(Br)cnc1N
Complexity: 178
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 5
RotatableBondCount: 2
Xlogp3: 1.2
CatalogNumber:
AB46484
ChemicalName:
Methyl 3-amino-6-bromopyrazine-2-carboxylate
CasNumber:
6966-01-4
MolecularFormula:
C6H6BrN3O2
MolecularWeight:
232.03473999999994
MdlNumber:
MFCD04038568
Smiles:
COC(=O)c1nc(Br)cnc1N
Complexity:
178
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
5
RotatableBondCount:
2
Xlogp3:
1.2