AI63696
94838-82-1 | 3,4-Methylenedioxyphenylboronic acid, pinacol ester
Manufacturer: A2B Chem
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CatalogNumber
AI63696
ChemicalName
3,4-Methylenedioxyphenylboronic acid, pinacol ester
CasNumber
94838-82-1
MolecularFormula
C13H17BO4
MolecularWeight
248.0827
MdlNumber
MFCD05663889
Smiles
CC1(C)OB(OC1(C)C)c1ccc2c(c1)OCO2
Complexity
315
Covalently-bondedUnitCount
1
HeavyAtomCount
18
HydrogenBondAcceptorCount
4
RotatableBondCount
1
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CatalogNumber: AI63696
ChemicalName: 3,4-Methylenedioxyphenylboronic acid, pinacol ester
CasNumber: 94838-82-1
MolecularFormula: C13H17BO4
MolecularWeight: 248.0827
MdlNumber: MFCD05663889
Smiles: CC1(C)OB(OC1(C)C)c1ccc2c(c1)OCO2
Complexity: 315
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 4
RotatableBondCount: 1
CatalogNumber:
AI63696
ChemicalName:
3,4-Methylenedioxyphenylboronic acid, pinacol ester
CasNumber:
94838-82-1
MolecularFormula:
C13H17BO4
MolecularWeight:
248.0827
MdlNumber:
MFCD05663889
Smiles:
CC1(C)OB(OC1(C)C)c1ccc2c(c1)OCO2
Complexity:
315
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
4
RotatableBondCount:
1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC[C@@H]([C@H]1OC(=O)[C@@H]2[C@H]1OC(O2)(C)C)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
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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:
OC[C@@H]([C@H]1OC(=O)[C@@H]2[C@H]1OC(O2)(C)C)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
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Smiles: CCC[C@@H]1CC[C@H](CC1)[C@@H]1CC[C@H](CC1)C(=O)Oc1ccc(c(c1)F)F
Complexity: 439
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
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MdlNumber:
__
Smiles:
CCC[C@@H]1CC[C@H](CC1)[C@@H]1CC[C@H](CC1)C(=O)Oc1ccc(c(c1)F)F
Complexity:
439
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
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Smiles: NCCc1c[nH]c2c1cc(Cl)cc2Cl.Cl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
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MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
NCCc1c[nH]c2c1cc(Cl)cc2Cl.Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__