AE62377
1365272-63-4 | 2-Bromo-6-isobutoxybenzonitrile
Manufacturer: A2B Chem
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CatalogNumber
AE62377
ChemicalName
2-Bromo-6-isobutoxybenzonitrile
CasNumber
1365272-63-4
MolecularFormula
C11H12BrNO
MolecularWeight
254.1231
MdlNumber
MFCD21609679
Smiles
CC(COc1cccc(c1C#N)Br)C
Complexity
221
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
2
RotatableBondCount
3
Xlogp3
3.6
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CatalogNumber: AE62377
ChemicalName: 2-Bromo-6-isobutoxybenzonitrile
CasNumber: 1365272-63-4
MolecularFormula: C11H12BrNO
MolecularWeight: 254.1231
MdlNumber: MFCD21609679
Smiles: CC(COc1cccc(c1C#N)Br)C
Complexity: 221
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 2
RotatableBondCount: 3
Xlogp3: 3.6
CatalogNumber:
AE62377
ChemicalName:
2-Bromo-6-isobutoxybenzonitrile
CasNumber:
1365272-63-4
MolecularFormula:
C11H12BrNO
MolecularWeight:
254.1231
MdlNumber:
MFCD21609679
Smiles:
CC(COc1cccc(c1C#N)Br)C
Complexity:
221
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
2
RotatableBondCount:
3
Xlogp3:
3.6
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CC(Oc1cccc(c1C(=O)N)Br)C
Complexity: 208
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 2.3
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CC(Oc1cccc(c1C(=O)N)Br)C
Complexity:
208
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
2.3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CC(Oc1cccc(c1C#N)Br)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CC(Oc1cccc(c1C#N)Br)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AE62380
ChemicalName: 1-Bromo-2-methanesulfonyl-4-nitro-5-(trifluoromethoxy)benzene
CasNumber: 1403483-61-3
MolecularFormula: C8H5BrF3NO5S
MolecularWeight: 364.0932
MdlNumber: MFCD22549344
Smiles: [O-][N+](=O)c1cc(c(cc1OC(F)(F)F)Br)S(=O)(=O)C
Complexity: 443
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 8
RotatableBondCount: 2
Xlogp3: 2.9
CatalogNumber:
AE62380
ChemicalName:
1-Bromo-2-methanesulfonyl-4-nitro-5-(trifluoromethoxy)benzene
CasNumber:
1403483-61-3
MolecularFormula:
C8H5BrF3NO5S
MolecularWeight:
364.0932
MdlNumber:
MFCD22549344
Smiles:
[O-][N+](=O)c1cc(c(cc1OC(F)(F)F)Br)S(=O)(=O)C
Complexity:
443
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
8
RotatableBondCount:
2
Xlogp3:
2.9