AE62632
1400645-11-5 | Methyl 1-tert-butyl-1,2,3-benzotriazole-5-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AE62632
ChemicalName
Methyl 1-tert-butyl-1,2,3-benzotriazole-5-carboxylate
CasNumber
1400645-11-5
MolecularFormula
C12H15N3O2
MolecularWeight
233.2664
MdlNumber
MFCD22421554
Smiles
COC(=O)c1ccc2c(c1)nnn2C(C)(C)C
Complexity
301
Covalently-bondedUnitCount
1
HeavyAtomCount
17
HydrogenBondAcceptorCount
4
RotatableBondCount
3
Xlogp3
1.9
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CatalogNumber: AE62632
ChemicalName: Methyl 1-tert-butyl-1,2,3-benzotriazole-5-carboxylate
CasNumber: 1400645-11-5
MolecularFormula: C12H15N3O2
MolecularWeight: 233.2664
MdlNumber: MFCD22421554
Smiles: COC(=O)c1ccc2c(c1)nnn2C(C)(C)C
Complexity: 301
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 4
RotatableBondCount: 3
Xlogp3: 1.9
CatalogNumber:
AE62632
ChemicalName:
Methyl 1-tert-butyl-1,2,3-benzotriazole-5-carboxylate
CasNumber:
1400645-11-5
MolecularFormula:
C12H15N3O2
MolecularWeight:
233.2664
MdlNumber:
MFCD22421554
Smiles:
COC(=O)c1ccc2c(c1)nnn2C(C)(C)C
Complexity:
301
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
4
RotatableBondCount:
3
Xlogp3:
1.9
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(=O)c1ccc2c(c1)nc(n2C(C)(C)C)C
Complexity: 324
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 2.6
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=O)c1ccc2c(c1)nc(n2C(C)(C)C)C
Complexity:
324
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
2.6
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Nc1cccc(c1)c1cc(F)cc(c1)Cl.Cl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Nc1cccc(c1)c1cc(F)cc(c1)Cl.Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCCn1c(C)nc2c1ccc(c2)C#N
Complexity: 267
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 2.4
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCCn1c(C)nc2c1ccc(c2)C#N
Complexity:
267
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
2.4