AI57562
860000-78-8 | Methyl 2-(benzyloxy)-5-bromobenzoate
Manufacturer: A2B Chem
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CatalogNumber
AI57562
ChemicalName
Methyl 2-(benzyloxy)-5-bromobenzoate
CasNumber
860000-78-8
MolecularFormula
C15H13BrO3
MolecularWeight
321.1659
MdlNumber
MFCD11112970
Smiles
COC(=O)c1cc(Br)ccc1OCc1ccccc1
Complexity
289
Covalently-bondedUnitCount
1
HeavyAtomCount
19
HydrogenBondAcceptorCount
3
RotatableBondCount
5
Xlogp3
3.9
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CatalogNumber: AI57562
ChemicalName: Methyl 2-(benzyloxy)-5-bromobenzoate
CasNumber: 860000-78-8
MolecularFormula: C15H13BrO3
MolecularWeight: 321.1659
MdlNumber: MFCD11112970
Smiles: COC(=O)c1cc(Br)ccc1OCc1ccccc1
Complexity: 289
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 3
RotatableBondCount: 5
Xlogp3: 3.9
CatalogNumber:
AI57562
ChemicalName:
Methyl 2-(benzyloxy)-5-bromobenzoate
CasNumber:
860000-78-8
MolecularFormula:
C15H13BrO3
MolecularWeight:
321.1659
MdlNumber:
MFCD11112970
Smiles:
COC(=O)c1cc(Br)ccc1OCc1ccccc1
Complexity:
289
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
3
RotatableBondCount:
5
Xlogp3:
3.9
CatalogNumber: AI57563
ChemicalName: Bis(4-methylthiazol-2-yl)methylene
CasNumber: 860180-92-3
MolecularFormula: C9H10N2S2
MolecularWeight: 210.3191
MdlNumber: MFCD26794392
Smiles: Cc1csc(n1)Cc1scc(n1)C
Complexity: 159
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 4
RotatableBondCount: 2
Xlogp3: 2.8
CatalogNumber:
AI57563
ChemicalName:
Bis(4-methylthiazol-2-yl)methylene
CasNumber:
860180-92-3
MolecularFormula:
C9H10N2S2
MolecularWeight:
210.3191
MdlNumber:
MFCD26794392
Smiles:
Cc1csc(n1)Cc1scc(n1)C
Complexity:
159
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
4
RotatableBondCount:
2
Xlogp3:
2.8
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)c1cc(N)c(c(c1)Br)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
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MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)c1cc(N)c(c(c1)Br)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AI57565
ChemicalName: Methyl 2-oxo-1,3-dihydrobenzimidazole-4-carboxylate
CasNumber: 860187-45-7
MolecularFormula: C9H8N2O3
MolecularWeight: 192.1714
MdlNumber: MFCD22562103
Smiles: COC(=O)c1cccc2c1[nH]c(=O)[nH]2
Complexity: 267
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 3
RotatableBondCount: 2
Xlogp3: 0.4
CatalogNumber:
AI57565
ChemicalName:
Methyl 2-oxo-1,3-dihydrobenzimidazole-4-carboxylate
CasNumber:
860187-45-7
MolecularFormula:
C9H8N2O3
MolecularWeight:
192.1714
MdlNumber:
MFCD22562103
Smiles:
COC(=O)c1cccc2c1[nH]c(=O)[nH]2
Complexity:
267
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
3
RotatableBondCount:
2
Xlogp3:
0.4