AA32113
1259023-29-4 | 2-(4-Bromo-3-chlorophenyl)acetonitrile
Manufacturer: A2B Chem
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CatalogNumber
AA32113
ChemicalName
2-(4-Bromo-3-chlorophenyl)acetonitrile
CasNumber
1259023-29-4
MolecularFormula
C8H5BrClN
MolecularWeight
230.489
MdlNumber
MFCD18321620
Smiles
N#CCc1ccc(c(c1)Cl)Br
Complexity
174
Covalently-bondedUnitCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
1
RotatableBondCount
1
Xlogp3
2.9
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CatalogNumber: AA32113
ChemicalName: 2-(4-Bromo-3-chlorophenyl)acetonitrile
CasNumber: 1259023-29-4
MolecularFormula: C8H5BrClN
MolecularWeight: 230.489
MdlNumber: MFCD18321620
Smiles: N#CCc1ccc(c(c1)Cl)Br
Complexity: 174
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 1
RotatableBondCount: 1
Xlogp3: 2.9
CatalogNumber:
AA32113
ChemicalName:
2-(4-Bromo-3-chlorophenyl)acetonitrile
CasNumber:
1259023-29-4
MolecularFormula:
C8H5BrClN
MolecularWeight:
230.489
MdlNumber:
MFCD18321620
Smiles:
N#CCc1ccc(c(c1)Cl)Br
Complexity:
174
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
1
RotatableBondCount:
1
Xlogp3:
2.9
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Smiles: Fc1ccc(cc1)[C@H]1CCCNC1
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
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Smiles:
Fc1ccc(cc1)[C@H]1CCCNC1
Complexity:
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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Xlogp3:
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Smiles: NCCCC[C@@H](C(=O)N1CCC[C@@H]1C(=O)N[C@H](C(=O)O)C(C)C)N
Complexity: __
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Smiles:
NCCCC[C@@H](C(=O)N1CCC[C@@H]1C(=O)N[C@H](C(=O)O)C(C)C)N
Complexity:
__
Covalently-bondedUnitCount:
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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Xlogp3:
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Smiles: O=c1ccnc([nH]1)c1cccs1
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HydrogenBondAcceptorCount: __
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Xlogp3: __
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__
ChemicalName:
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
O=c1ccnc([nH]1)c1cccs1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__