AE62225
1420800-14-1 | Methyl 7-bromo-1-methyl-1,2,3-benzotriazole-5-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AE62225
ChemicalName
Methyl 7-bromo-1-methyl-1,2,3-benzotriazole-5-carboxylate
CasNumber
1420800-14-1
MolecularFormula
C9H8BrN3O2
MolecularWeight
270.0827
MdlNumber
MFCD22689137
Smiles
COC(=O)c1cc(Br)c2c(c1)nnn2C
Complexity
264
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
4
RotatableBondCount
2
Xlogp3
1.7
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CatalogNumber: AE62225
ChemicalName: Methyl 7-bromo-1-methyl-1,2,3-benzotriazole-5-carboxylate
CasNumber: 1420800-14-1
MolecularFormula: C9H8BrN3O2
MolecularWeight: 270.0827
MdlNumber: MFCD22689137
Smiles: COC(=O)c1cc(Br)c2c(c1)nnn2C
Complexity: 264
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 4
RotatableBondCount: 2
Xlogp3: 1.7
CatalogNumber:
AE62225
ChemicalName:
Methyl 7-bromo-1-methyl-1,2,3-benzotriazole-5-carboxylate
CasNumber:
1420800-14-1
MolecularFormula:
C9H8BrN3O2
MolecularWeight:
270.0827
MdlNumber:
MFCD22689137
Smiles:
COC(=O)c1cc(Br)c2c(c1)nnn2C
Complexity:
264
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
4
RotatableBondCount:
2
Xlogp3:
1.7
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCCCn1c(C)nc2c1ccc(c2)C(=O)OC
Complexity: 296
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 2.9
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCCCn1c(C)nc2c1ccc(c2)C(=O)OC
Complexity:
296
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
2.9
CatalogNumber: AE62227
ChemicalName: Methyl 1-butyl-1,2,3-benzotriazole-5-carboxylate
CasNumber: 1400644-56-5
MolecularFormula: C12H15N3O2
MolecularWeight: 233.2664
MdlNumber: MFCD22421553
Smiles: CCCCn1nnc2c1ccc(c2)C(=O)OC
Complexity: 273
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 4
RotatableBondCount: 5
Xlogp3: 2.4
CatalogNumber:
AE62227
ChemicalName:
Methyl 1-butyl-1,2,3-benzotriazole-5-carboxylate
CasNumber:
1400644-56-5
MolecularFormula:
C12H15N3O2
MolecularWeight:
233.2664
MdlNumber:
MFCD22421553
Smiles:
CCCCn1nnc2c1ccc(c2)C(=O)OC
Complexity:
273
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
4
RotatableBondCount:
5
Xlogp3:
2.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCCCn1cnc2c1ccc(c2)C(=O)OC
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCCCn1cnc2c1ccc(c2)C(=O)OC
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__