AI63354
945391-06-0 | 3-chloro-4-(tetramethyl-1,3,2-dioxaborolan-2-yl)benzonitrile
Manufacturer: A2B Chem
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CatalogNumber
AI63354
ChemicalName
3-chloro-4-(tetramethyl-1,3,2-dioxaborolan-2-yl)benzonitrile
CasNumber
945391-06-0
MolecularFormula
C13H15BClNO2
MolecularWeight
263.5277
MdlNumber
MFCD18072641
Smiles
N#Cc1ccc(c(c1)Cl)B1OC(C(O1)(C)C)(C)C
Complexity
360
Covalently-bondedUnitCount
1
HeavyAtomCount
18
HydrogenBondAcceptorCount
3
RotatableBondCount
1
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CatalogNumber: AI63354
ChemicalName: 3-chloro-4-(tetramethyl-1,3,2-dioxaborolan-2-yl)benzonitrile
CasNumber: 945391-06-0
MolecularFormula: C13H15BClNO2
MolecularWeight: 263.5277
MdlNumber: MFCD18072641
Smiles: N#Cc1ccc(c(c1)Cl)B1OC(C(O1)(C)C)(C)C
Complexity: 360
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 3
RotatableBondCount: 1
CatalogNumber:
AI63354
ChemicalName:
3-chloro-4-(tetramethyl-1,3,2-dioxaborolan-2-yl)benzonitrile
CasNumber:
945391-06-0
MolecularFormula:
C13H15BClNO2
MolecularWeight:
263.5277
MdlNumber:
MFCD18072641
Smiles:
N#Cc1ccc(c(c1)Cl)B1OC(C(O1)(C)C)(C)C
Complexity:
360
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
3
RotatableBondCount:
1
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Smiles: Nc1ccc2c(c1)sc(n2)Br
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Smiles:
Nc1ccc2c(c1)sc(n2)Br
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Smiles: NCc1ncc([nH]1)c1ccccc1.Cl
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NCc1ncc([nH]1)c1ccccc1.Cl
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Smiles: CCOC(=O)CC(c1ccc(cc1)OC(C)C)N.Cl
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Smiles:
CCOC(=O)CC(c1ccc(cc1)OC(C)C)N.Cl
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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