AB63207
118449-57-3 | 3-(4-Bromophenoxy)propanenitrile
Manufacturer: A2B Chem
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CatalogNumber
AB63207
ChemicalName
3-(4-Bromophenoxy)propanenitrile
CasNumber
118449-57-3
MolecularFormula
C9H8BrNO
MolecularWeight
226.0699
MdlNumber
MFCD00634314
Smiles
N#CCCOc1ccc(cc1)Br
Complexity
167
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
2
RotatableBondCount
3
Xlogp3
2.3
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CatalogNumber: AB63207
ChemicalName: 3-(4-Bromophenoxy)propanenitrile
CasNumber: 118449-57-3
MolecularFormula: C9H8BrNO
MolecularWeight: 226.0699
MdlNumber: MFCD00634314
Smiles: N#CCCOc1ccc(cc1)Br
Complexity: 167
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 2
RotatableBondCount: 3
Xlogp3: 2.3
CatalogNumber:
AB63207
ChemicalName:
3-(4-Bromophenoxy)propanenitrile
CasNumber:
118449-57-3
MolecularFormula:
C9H8BrNO
MolecularWeight:
226.0699
MdlNumber:
MFCD00634314
Smiles:
N#CCCOc1ccc(cc1)Br
Complexity:
167
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
2
RotatableBondCount:
3
Xlogp3:
2.3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)CCc1cn(nc1c1ccc(cc1)Br)c1ccc(cc1)Cl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)CCc1cn(nc1c1ccc(cc1)Br)c1ccc(cc1)Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Brc1ccc(cc1)c1n[nH]c(c1)C(=O)O
Complexity: 242
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 2.4
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Brc1ccc(cc1)c1n[nH]c(c1)C(=O)O
Complexity:
242
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
2.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)CCc1cn(nc1c1ccc(cc1)Br)c1ccccc1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)CCc1cn(nc1c1ccc(cc1)Br)c1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__