AI29677
1310404-79-5 | 4,4,6-Trimethyl-2-(3-methylphenyl)-1,3,2-dioxaborinane
Manufacturer: A2B Chem
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CatalogNumber
AI29677
ChemicalName
4,4,6-Trimethyl-2-(3-methylphenyl)-1,3,2-dioxaborinane
CasNumber
1310404-79-5
MolecularFormula
C13H19BO2
MolecularWeight
218.0998
MdlNumber
MFCD08436973
Smiles
CC1OB(OC(C1)(C)C)c1cccc(c1)C
Complexity
242
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
2
RotatableBondCount
1
UndefinedAtomStereocenterCount
1
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CatalogNumber: AI29677
ChemicalName: 4,4,6-Trimethyl-2-(3-methylphenyl)-1,3,2-dioxaborinane
CasNumber: 1310404-79-5
MolecularFormula: C13H19BO2
MolecularWeight: 218.0998
MdlNumber: MFCD08436973
Smiles: CC1OB(OC(C1)(C)C)c1cccc(c1)C
Complexity: 242
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 2
RotatableBondCount: 1
UndefinedAtomStereocenterCount: 1
CatalogNumber:
AI29677
ChemicalName:
4,4,6-Trimethyl-2-(3-methylphenyl)-1,3,2-dioxaborinane
CasNumber:
1310404-79-5
MolecularFormula:
C13H19BO2
MolecularWeight:
218.0998
MdlNumber:
MFCD08436973
Smiles:
CC1OB(OC(C1)(C)C)c1cccc(c1)C
Complexity:
242
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
2
RotatableBondCount:
1
UndefinedAtomStereocenterCount:
1
CatalogNumber: AI29678
ChemicalName: 4-Bromo-5-methyl-thiophene-2-boronic acid pinacol ester
CasNumber: 1310404-98-8
MolecularFormula: C11H16BBrO2S
MolecularWeight: 303.0235
MdlNumber: MFCD08063142
Smiles: Brc1cc(sc1C)B1OC(C(O1)(C)C)(C)C
Complexity: 269
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 3
RotatableBondCount: 1
UndefinedAtomStereocenterCount: __
CatalogNumber:
AI29678
ChemicalName:
4-Bromo-5-methyl-thiophene-2-boronic acid pinacol ester
CasNumber:
1310404-98-8
MolecularFormula:
C11H16BBrO2S
MolecularWeight:
303.0235
MdlNumber:
MFCD08063142
Smiles:
Brc1cc(sc1C)B1OC(C(O1)(C)C)(C)C
Complexity:
269
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
3
RotatableBondCount:
1
UndefinedAtomStereocenterCount:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Brc1ccc(c(c1O)F)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Brc1ccc(c(c1O)F)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OB(c1ccc(cc1)CCNC(=O)OC(C)(C)C)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OB(c1ccc(cc1)CCNC(=O)OC(C)(C)C)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__