AX55586
2096331-91-6 | [3-(Benzyloxy)-2,4-difluoro-5-methylphenyl]boronic acid
Manufacturer: A2B Chem
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CatalogNumber
AX55586
ChemicalName
[3-(Benzyloxy)-2,4-difluoro-5-methylphenyl]boronic acid
CasNumber
2096331-91-6
MolecularFormula
C14H13BF2O3
MolecularWeight
278.059
MdlNumber
MFCD20231453
Smiles
Cc1cc(B(O)O)c(c(c1F)OCc1ccccc1)F
Complexity
300
Covalently-bondedUnitCount
1
HeavyAtomCount
20
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
2
RotatableBondCount
4
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CatalogNumber: AX55586
ChemicalName: [3-(Benzyloxy)-2,4-difluoro-5-methylphenyl]boronic acid
CasNumber: 2096331-91-6
MolecularFormula: C14H13BF2O3
MolecularWeight: 278.059
MdlNumber: MFCD20231453
Smiles: Cc1cc(B(O)O)c(c(c1F)OCc1ccccc1)F
Complexity: 300
Covalently-bondedUnitCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 2
RotatableBondCount: 4
CatalogNumber:
AX55586
ChemicalName:
[3-(Benzyloxy)-2,4-difluoro-5-methylphenyl]boronic acid
CasNumber:
2096331-91-6
MolecularFormula:
C14H13BF2O3
MolecularWeight:
278.059
MdlNumber:
MFCD20231453
Smiles:
Cc1cc(B(O)O)c(c(c1F)OCc1ccccc1)F
Complexity:
300
Covalently-bondedUnitCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
2
RotatableBondCount:
4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OB(c1cc(OCc2ccccc2)ncc1F)O
Complexity: 252
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OB(c1cc(OCc2ccccc2)ncc1F)O
Complexity:
252
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
CatalogNumber: AX55588
ChemicalName: [3-(Benzyloxy)-5-chloro-4-fluorophenyl]boronic acid
CasNumber: 2096340-14-4
MolecularFormula: C13H11BClFO3
MolecularWeight: 280.487
MdlNumber: MFCD20491426
Smiles: Clc1cc(cc(c1F)OCc1ccccc1)B(O)O
Complexity: 277
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 4
CatalogNumber:
AX55588
ChemicalName:
[3-(Benzyloxy)-5-chloro-4-fluorophenyl]boronic acid
CasNumber:
2096340-14-4
MolecularFormula:
C13H11BClFO3
MolecularWeight:
280.487
MdlNumber:
MFCD20491426
Smiles:
Clc1cc(cc(c1F)OCc1ccccc1)B(O)O
Complexity:
277
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
4
CatalogNumber: AX55589
ChemicalName: 5-Fluoro-2-aminomethylphenylboronic acid, pinacol ester
CasNumber: 2096337-86-7
MolecularFormula: C13H19BFNO2
MolecularWeight: 251.1049
MdlNumber: MFCD18730149
Smiles: NCc1ccc(cc1B1OC(C(O1)(C)C)(C)C)F
Complexity: 295
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 2
CatalogNumber:
AX55589
ChemicalName:
5-Fluoro-2-aminomethylphenylboronic acid, pinacol ester
CasNumber:
2096337-86-7
MolecularFormula:
C13H19BFNO2
MolecularWeight:
251.1049
MdlNumber:
MFCD18730149
Smiles:
NCc1ccc(cc1B1OC(C(O1)(C)C)(C)C)F
Complexity:
295
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
2