AB44557
624741-47-5 | 3-Fluoro-2-(tetramethyl-1,3,2-dioxaborolan-2-yl)benzonitrile
Manufacturer: A2B Chem
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CatalogNumber
AB44557
ChemicalName
3-Fluoro-2-(tetramethyl-1,3,2-dioxaborolan-2-yl)benzonitrile
CasNumber
624741-47-5
MolecularFormula
C13H15BFNO2
MolecularWeight
247.0731
MdlNumber
MFCD18729920
Smiles
N#Cc1cccc(c1B1OC(C(O1)(C)C)(C)C)F
Complexity
360
Covalently-bondedUnitCount
1
HeavyAtomCount
18
HydrogenBondAcceptorCount
4
RotatableBondCount
1
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CatalogNumber: AB44557
ChemicalName: 3-Fluoro-2-(tetramethyl-1,3,2-dioxaborolan-2-yl)benzonitrile
CasNumber: 624741-47-5
MolecularFormula: C13H15BFNO2
MolecularWeight: 247.0731
MdlNumber: MFCD18729920
Smiles: N#Cc1cccc(c1B1OC(C(O1)(C)C)(C)C)F
Complexity: 360
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 4
RotatableBondCount: 1
CatalogNumber:
AB44557
ChemicalName:
3-Fluoro-2-(tetramethyl-1,3,2-dioxaborolan-2-yl)benzonitrile
CasNumber:
624741-47-5
MolecularFormula:
C13H15BFNO2
MolecularWeight:
247.0731
MdlNumber:
MFCD18729920
Smiles:
N#Cc1cccc(c1B1OC(C(O1)(C)C)(C)C)F
Complexity:
360
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
4
RotatableBondCount:
1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=Cc1cccc(c1O)F
Complexity: 127
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=Cc1cccc(c1O)F
Complexity:
127
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
CatalogNumber: AB44559
ChemicalName: 3-Fluoro-2-nitropyridine
CasNumber: 54231-35-5
MolecularFormula: C5H3FN2O2
MolecularWeight: 142.0879
MdlNumber: MFCD04114127
Smiles: [O-][N+](=O)c1ncccc1F
Complexity: 136
Covalently-bondedUnitCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 4
RotatableBondCount: __
CatalogNumber:
AB44559
ChemicalName:
3-Fluoro-2-nitropyridine
CasNumber:
54231-35-5
MolecularFormula:
C5H3FN2O2
MolecularWeight:
142.0879
MdlNumber:
MFCD04114127
Smiles:
[O-][N+](=O)c1ncccc1F
Complexity:
136
Covalently-bondedUnitCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
4
RotatableBondCount:
__
CatalogNumber: AB44560
ChemicalName: 3-Fluoro-4-(4-methylpiperazin-1-yl)aniline
CasNumber: 221198-99-8
MolecularFormula: C11H16FN3
MolecularWeight: 209.2632
MdlNumber: MFCD05663793
Smiles: CN1CCN(CC1)c1ccc(cc1F)N
Complexity: 204
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 4
RotatableBondCount: 1
CatalogNumber:
AB44560
ChemicalName:
3-Fluoro-4-(4-methylpiperazin-1-yl)aniline
CasNumber:
221198-99-8
MolecularFormula:
C11H16FN3
MolecularWeight:
209.2632
MdlNumber:
MFCD05663793
Smiles:
CN1CCN(CC1)c1ccc(cc1F)N
Complexity:
204
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
4
RotatableBondCount:
1