AX55317
2096339-71-6 | 3-(1-Cyanocyclopentyl)-2-fluorophenylboronic acid
Manufacturer: A2B Chem
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CatalogNumber
AX55317
ChemicalName
3-(1-Cyanocyclopentyl)-2-fluorophenylboronic acid
CasNumber
2096339-71-6
MolecularFormula
C12H13BFNO2
MolecularWeight
233.0465
MdlNumber
MFCD21609519
Smiles
N#CC1(CCCC1)c1cccc(c1F)B(O)O
Complexity
322
Covalently-bondedUnitCount
1
HeavyAtomCount
17
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
2
RotatableBondCount
2
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CatalogNumber: AX55317
ChemicalName: 3-(1-Cyanocyclopentyl)-2-fluorophenylboronic acid
CasNumber: 2096339-71-6
MolecularFormula: C12H13BFNO2
MolecularWeight: 233.0465
MdlNumber: MFCD21609519
Smiles: N#CC1(CCCC1)c1cccc(c1F)B(O)O
Complexity: 322
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 2
CatalogNumber:
AX55317
ChemicalName:
3-(1-Cyanocyclopentyl)-2-fluorophenylboronic acid
CasNumber:
2096339-71-6
MolecularFormula:
C12H13BFNO2
MolecularWeight:
233.0465
MdlNumber:
MFCD21609519
Smiles:
N#CC1(CCCC1)c1cccc(c1F)B(O)O
Complexity:
322
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
2
CatalogNumber: AX55318
ChemicalName: 4-Fluoro-5-methyl-2-propoxyphenylboronic acid
CasNumber: 2096331-30-3
MolecularFormula: C10H14BFO3
MolecularWeight: 212.0258
MdlNumber: MFCD19684097
Smiles: CCCOc1cc(F)c(cc1B(O)O)C
Complexity: 192
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 4
CatalogNumber:
AX55318
ChemicalName:
4-Fluoro-5-methyl-2-propoxyphenylboronic acid
CasNumber:
2096331-30-3
MolecularFormula:
C10H14BFO3
MolecularWeight:
212.0258
MdlNumber:
MFCD19684097
Smiles:
CCCOc1cc(F)c(cc1B(O)O)C
Complexity:
192
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: [O-][N+](=O)c1cc(ccc1OC(F)(F)F)B1OC(C(O1)(C)C)(C)C
Complexity: 450
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
[O-][N+](=O)c1cc(ccc1OC(F)(F)F)B1OC(C(O1)(C)C)(C)C
Complexity:
450
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
CatalogNumber: AX55320
ChemicalName: 1-(4-Nitrophenyl)-3-[3-(tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]urea
CasNumber: 2096998-08-0
MolecularFormula: C19H22BN3O5
MolecularWeight: 383.2061
MdlNumber: MFCD20231472
Smiles: O=C(Nc1ccc(cc1)[N+](=O)[O-])Nc1cccc(c1)B1OC(C(O1)(C)C)(C)C
Complexity: 571
Covalently-bondedUnitCount: 1
HeavyAtomCount: 28
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 2
RotatableBondCount: 3
CatalogNumber:
AX55320
ChemicalName:
1-(4-Nitrophenyl)-3-[3-(tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]urea
CasNumber:
2096998-08-0
MolecularFormula:
C19H22BN3O5
MolecularWeight:
383.2061
MdlNumber:
MFCD20231472
Smiles:
O=C(Nc1ccc(cc1)[N+](=O)[O-])Nc1cccc(c1)B1OC(C(O1)(C)C)(C)C
Complexity:
571
Covalently-bondedUnitCount:
1
HeavyAtomCount:
28
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
2
RotatableBondCount:
3