AB50166
35219-13-7 | 4-(1,3,4-Oxadiazol-2-yl)aniline
Manufacturer: A2B Chem
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CatalogNumber
AB50166
ChemicalName
4-(1,3,4-Oxadiazol-2-yl)aniline
CasNumber
35219-13-7
MolecularFormula
C8H7N3O
MolecularWeight
161.1607
MdlNumber
MFCD08059433
Smiles
Nc1ccc(cc1)c1ocnn1
Complexity
145
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
0.7
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CatalogNumber: AB50166
ChemicalName: 4-(1,3,4-Oxadiazol-2-yl)aniline
CasNumber: 35219-13-7
MolecularFormula: C8H7N3O
MolecularWeight: 161.1607
MdlNumber: MFCD08059433
Smiles: Nc1ccc(cc1)c1ocnn1
Complexity: 145
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 0.7
CatalogNumber:
AB50166
ChemicalName:
4-(1,3,4-Oxadiazol-2-yl)aniline
CasNumber:
35219-13-7
MolecularFormula:
C8H7N3O
MolecularWeight:
161.1607
MdlNumber:
MFCD08059433
Smiles:
Nc1ccc(cc1)c1ocnn1
Complexity:
145
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
0.7
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(=O)c1cc2c(s1)ccc(c2)Cl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=O)c1cc2c(s1)ccc(c2)Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCCCC(=O)OC/C=C(/CCC=C(C)C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCCCC(=O)OC/C=C(/CCC=C(C)C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AB50169
ChemicalName: 4-Bromo-1-(bromomethyl)-2-(trifluoromethyl)benzene
CasNumber: 335013-18-8
MolecularFormula: C8H5Br2F3
MolecularWeight: 317.9285
MdlNumber: MFCD13185414
Smiles: BrCc1ccc(cc1C(F)(F)F)Br
Complexity: 169
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: __
RotatableBondCount: 1
Xlogp3: 4.1
CatalogNumber:
AB50169
ChemicalName:
4-Bromo-1-(bromomethyl)-2-(trifluoromethyl)benzene
CasNumber:
335013-18-8
MolecularFormula:
C8H5Br2F3
MolecularWeight:
317.9285
MdlNumber:
MFCD13185414
Smiles:
BrCc1ccc(cc1C(F)(F)F)Br
Complexity:
169
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
__
RotatableBondCount:
1
Xlogp3:
4.1