AE62630
1226205-60-2 | 3-(2-Methylphenyl)picolinic acid
Manufacturer: A2B Chem
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CatalogNumber
AE62630
ChemicalName
3-(2-Methylphenyl)picolinic acid
CasNumber
1226205-60-2
MolecularFormula
C13H11NO2
MolecularWeight
213.2319
MdlNumber
MFCD16308580
Smiles
Cc1ccccc1c1cccnc1C(=O)O
Complexity
254
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
2.7
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CatalogNumber: AE62630
ChemicalName: 3-(2-Methylphenyl)picolinic acid
CasNumber: 1226205-60-2
MolecularFormula: C13H11NO2
MolecularWeight: 213.2319
MdlNumber: MFCD16308580
Smiles: Cc1ccccc1c1cccnc1C(=O)O
Complexity: 254
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 2.7
CatalogNumber:
AE62630
ChemicalName:
3-(2-Methylphenyl)picolinic acid
CasNumber:
1226205-60-2
MolecularFormula:
C13H11NO2
MolecularWeight:
213.2319
MdlNumber:
MFCD16308580
Smiles:
Cc1ccccc1c1cccnc1C(=O)O
Complexity:
254
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
2.7
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C1CC(C)(C)c2c(N1)cc(cc2)Cl
Complexity: 252
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 2.6
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C1CC(C)(C)c2c(N1)cc(cc2)Cl
Complexity:
252
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
2.6
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
HydrogenBondDonorCount: __
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
HydrogenBondDonorCount:
__
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: __
HydrogenBondDonorCount: __
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:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
2.6