AF32704
269409-74-7 | 3-Methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoic acid
Manufacturer: A2B Chem
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CatalogNumber
AF32704
ChemicalName
3-Methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoic acid
CasNumber
269409-74-7
MolecularFormula
C14H19BO4
MolecularWeight
262.1093
MdlNumber
MFCD08061640
Smiles
Cc1cc(ccc1B1OC(C(O1)(C)C)(C)C)C(=O)O
Complexity
351
Covalently-bondedUnitCount
1
HeavyAtomCount
19
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
2
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CatalogNumber: AF32704
ChemicalName: 3-Methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoic acid
CasNumber: 269409-74-7
MolecularFormula: C14H19BO4
MolecularWeight: 262.1093
MdlNumber: MFCD08061640
Smiles: Cc1cc(ccc1B1OC(C(O1)(C)C)(C)C)C(=O)O
Complexity: 351
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 2
CatalogNumber:
AF32704
ChemicalName:
3-Methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoic acid
CasNumber:
269409-74-7
MolecularFormula:
C14H19BO4
MolecularWeight:
262.1093
MdlNumber:
MFCD08061640
Smiles:
Cc1cc(ccc1B1OC(C(O1)(C)C)(C)C)C(=O)O
Complexity:
351
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Fc1cc(F)c2c(c1)c(Cl)ccn2
Complexity: 191
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
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__
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Fc1cc(F)c2c(c1)c(Cl)ccn2
Complexity:
191
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
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RotatableBondCount:
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MolecularFormula: __
MolecularWeight: __
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Smiles: CC(Oc1ccc(cc1C(F)(F)F)C(=O)O)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
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RotatableBondCount: __
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
CC(Oc1ccc(cc1C(F)(F)F)C(=O)O)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Smiles: O=C1C=C(NC(=O)c2ccccc2O)[C@H]([C@@H]2[C@H]1O2)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
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CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
O=C1C=C(NC(=O)c2ccccc2O)[C@H]([C@@H]2[C@H]1O2)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__