AX55173
2096335-81-6 | 2-Chloro-5-methoxy-4-methylbenzeneboronic acid
Manufacturer: A2B Chem
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CatalogNumber
AX55173
ChemicalName
2-Chloro-5-methoxy-4-methylbenzeneboronic acid
CasNumber
2096335-81-6
MolecularFormula
C8H10BClO3
MolecularWeight
200.4272
MdlNumber
MFCD11870203
Smiles
COc1cc(B(O)O)c(cc1C)Cl
Complexity
168
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
2
RotatableBondCount
2
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CatalogNumber: AX55173
ChemicalName: 2-Chloro-5-methoxy-4-methylbenzeneboronic acid
CasNumber: 2096335-81-6
MolecularFormula: C8H10BClO3
MolecularWeight: 200.4272
MdlNumber: MFCD11870203
Smiles: COc1cc(B(O)O)c(cc1C)Cl
Complexity: 168
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: 2
CatalogNumber:
AX55173
ChemicalName:
2-Chloro-5-methoxy-4-methylbenzeneboronic acid
CasNumber:
2096335-81-6
MolecularFormula:
C8H10BClO3
MolecularWeight:
200.4272
MdlNumber:
MFCD11870203
Smiles:
COc1cc(B(O)O)c(cc1C)Cl
Complexity:
168
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CNCc1ccc(cc1B1OC(C(O1)(C)C)(C)C)F
Complexity: 309
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CNCc1ccc(cc1B1OC(C(O1)(C)C)(C)C)F
Complexity:
309
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
CatalogNumber: AX55175
ChemicalName: 4-Chloro-2-(N-methylaminomethyl)phenylboronic acid, pinacol ester
CasNumber: 2096333-97-8
MolecularFormula: C14H21BClNO2
MolecularWeight: 281.586
MdlNumber: MFCD18730284
Smiles: CNCc1cc(Cl)ccc1B1OC(C(O1)(C)C)(C)C
Complexity: 309
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 3
CatalogNumber:
AX55175
ChemicalName:
4-Chloro-2-(N-methylaminomethyl)phenylboronic acid, pinacol ester
CasNumber:
2096333-97-8
MolecularFormula:
C14H21BClNO2
MolecularWeight:
281.586
MdlNumber:
MFCD18730284
Smiles:
CNCc1cc(Cl)ccc1B1OC(C(O1)(C)C)(C)C
Complexity:
309
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
3
CatalogNumber: AX55176
ChemicalName: 4-Cyano-3-isobutoxyphenylboronic acid
CasNumber: 2096335-50-9
MolecularFormula: C11H14BNO3
MolecularWeight: 219.0448
MdlNumber: MFCD19684100
Smiles: OB(c1ccc(c(c1)OCC(C)C)C#N)O
Complexity: 261
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 4
CatalogNumber:
AX55176
ChemicalName:
4-Cyano-3-isobutoxyphenylboronic acid
CasNumber:
2096335-50-9
MolecularFormula:
C11H14BNO3
MolecularWeight:
219.0448
MdlNumber:
MFCD19684100
Smiles:
OB(c1ccc(c(c1)OCC(C)C)C#N)O
Complexity:
261
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
4