AB30311
263159-64-4 | 2-Bromo-3-methylbenzonitrile
Manufacturer: A2B Chem
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CatalogNumber
AB30311
ChemicalName
2-Bromo-3-methylbenzonitrile
CasNumber
263159-64-4
MolecularFormula
C8H6BrN
MolecularWeight
196.0439
MdlNumber
MFCD09025664
Smiles
N#Cc1cccc(c1Br)C
Complexity
158
Covalently-bondedUnitCount
1
HeavyAtomCount
10
HydrogenBondAcceptorCount
1
Xlogp3
2.7
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CatalogNumber: AB30311
ChemicalName: 2-Bromo-3-methylbenzonitrile
CasNumber: 263159-64-4
MolecularFormula: C8H6BrN
MolecularWeight: 196.0439
MdlNumber: MFCD09025664
Smiles: N#Cc1cccc(c1Br)C
Complexity: 158
Covalently-bondedUnitCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 1
Xlogp3: 2.7
CatalogNumber:
AB30311
ChemicalName:
2-Bromo-3-methylbenzonitrile
CasNumber:
263159-64-4
MolecularFormula:
C8H6BrN
MolecularWeight:
196.0439
MdlNumber:
MFCD09025664
Smiles:
N#Cc1cccc(c1Br)C
Complexity:
158
Covalently-bondedUnitCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
1
Xlogp3:
2.7
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
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Smiles: CC(CCC[C@H]([C@H]1CC[C@@H]2[C@]1(C)CC[C@H]1[C@H]2CC=C2[C@@]1(CC[C@@H](C2)O)C(=O)O)C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
Xlogp3: __
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Smiles:
CC(CCC[C@H]([C@H]1CC[C@@H]2[C@]1(C)CC[C@H]1[C@H]2CC=C2[C@@]1(CC[C@@H](C2)O)C(=O)O)C)C
Complexity:
__
Covalently-bondedUnitCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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Xlogp3:
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Smiles: O[Si](O)(O)O.[Li].[Li].[Li].[Li]
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Smiles:
O[Si](O)(O)O.[Li].[Li].[Li].[Li]
Complexity:
__
Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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Xlogp3:
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Smiles: CCCCCCCC/C=C\CCCCCCCC(=O)O[C@@H](COC(=O)CCCCCCC/C=C\C/C=C\CCCCC)CO
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
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Smiles:
CCCCCCCC/C=C\CCCCCCCC(=O)O[C@@H](COC(=O)CCCCCCC/C=C\C/C=C\CCCCC)CO
Complexity:
__
Covalently-bondedUnitCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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Xlogp3:
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