AB75966
4068-76-2 | Methyl 5-bromosalicylate
Manufacturer: A2B Chem
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CatalogNumber
AB75966
ChemicalName
Methyl 5-bromosalicylate
CasNumber
4068-76-2
MolecularFormula
C8H7BrO3
MolecularWeight
231.0434
MdlNumber
MFCD00016460
Smiles
COC(=O)c1cc(Br)ccc1O
NscNumber
30264
Complexity
172
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
3.6
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CatalogNumber: AB75966
ChemicalName: Methyl 5-bromosalicylate
CasNumber: 4068-76-2
MolecularFormula: C8H7BrO3
MolecularWeight: 231.0434
MdlNumber: MFCD00016460
Smiles: COC(=O)c1cc(Br)ccc1O
NscNumber: 30264
Complexity: 172
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 3.6
CatalogNumber:
AB75966
ChemicalName:
Methyl 5-bromosalicylate
CasNumber:
4068-76-2
MolecularFormula:
C8H7BrO3
MolecularWeight:
231.0434
MdlNumber:
MFCD00016460
Smiles:
COC(=O)c1cc(Br)ccc1O
NscNumber:
30264
Complexity:
172
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
3.6
CatalogNumber: AB75967
ChemicalName: Methyl 5-chloro-1H-indazole-3-carboxylate
CasNumber: 1079-46-5
MolecularFormula: C9H7ClN2O2
MolecularWeight: 210.6171
MdlNumber: MFCD07371574
Smiles: COC(=O)c1n[nH]c2c1cc(Cl)cc2
NscNumber: __
Complexity: 237
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 2.4
CatalogNumber:
AB75967
ChemicalName:
Methyl 5-chloro-1H-indazole-3-carboxylate
CasNumber:
1079-46-5
MolecularFormula:
C9H7ClN2O2
MolecularWeight:
210.6171
MdlNumber:
MFCD07371574
Smiles:
COC(=O)c1n[nH]c2c1cc(Cl)cc2
NscNumber:
__
Complexity:
237
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
2.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(=O)c1cc(Cl)ccc1O
NscNumber: __
Complexity: 172
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 3.6
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=O)c1cc(Cl)ccc1O
NscNumber:
__
Complexity:
172
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
3.6
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(=O)c1cc(Cl)ccc1OC
NscNumber: __
Complexity: 184
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 3.4
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=O)c1cc(Cl)ccc1OC
NscNumber:
__
Complexity:
184
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
3.4