AB46490
51171-02-9 | Methyl 3-bromopyrazine-2-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AB46490
ChemicalName
Methyl 3-bromopyrazine-2-carboxylate
CasNumber
51171-02-9
MolecularFormula
C6H5BrN2O2
MolecularWeight
217.0201
MdlNumber
MFCD08753935
Smiles
COC(=O)c1nccnc1Br
Complexity
154
Covalently-bondedUnitCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
4
RotatableBondCount
2
Xlogp3
0.8
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CatalogNumber: AB46490
ChemicalName: Methyl 3-bromopyrazine-2-carboxylate
CasNumber: 51171-02-9
MolecularFormula: C6H5BrN2O2
MolecularWeight: 217.0201
MdlNumber: MFCD08753935
Smiles: COC(=O)c1nccnc1Br
Complexity: 154
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 4
RotatableBondCount: 2
Xlogp3: 0.8
CatalogNumber:
AB46490
ChemicalName:
Methyl 3-bromopyrazine-2-carboxylate
CasNumber:
51171-02-9
MolecularFormula:
C6H5BrN2O2
MolecularWeight:
217.0201
MdlNumber:
MFCD08753935
Smiles:
COC(=O)c1nccnc1Br
Complexity:
154
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
4
RotatableBondCount:
2
Xlogp3:
0.8
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(=O)CC=C
Complexity: 76.1
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 0.9
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=O)CC=C
Complexity:
76.1
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
0.9
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(=O)CC(=O)Cl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=O)CC(=O)Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AB46493
ChemicalName: Methyl 3-chloro-5-formylbenzoate
CasNumber: 879542-48-0
MolecularFormula: C9H7ClO3
MolecularWeight: 198.6031
MdlNumber: MFCD22544335
Smiles: COC(=O)c1cc(C=O)cc(c1)Cl
Complexity: 205
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 3
RotatableBondCount: 3
Xlogp3: 2.3
CatalogNumber:
AB46493
ChemicalName:
Methyl 3-chloro-5-formylbenzoate
CasNumber:
879542-48-0
MolecularFormula:
C9H7ClO3
MolecularWeight:
198.6031
MdlNumber:
MFCD22544335
Smiles:
COC(=O)c1cc(C=O)cc(c1)Cl
Complexity:
205
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
3
RotatableBondCount:
3
Xlogp3:
2.3