AB50425
1131912-76-9 | Tetrahydropyran-4-boronic acid, pinacol ester
Manufacturer: A2B Chem
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CatalogNumber
AB50425
ChemicalName
Tetrahydropyran-4-boronic acid, pinacol ester
CasNumber
1131912-76-9
MolecularFormula
C11H21BO3
MolecularWeight
212.0936
MdlNumber
MFCD00667560
Smiles
CC1(C)OB(OC1(C)C)C1CCOCC1
Complexity
218
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
3
RotatableBondCount
1
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CatalogNumber: AB50425
ChemicalName: Tetrahydropyran-4-boronic acid, pinacol ester
CasNumber: 1131912-76-9
MolecularFormula: C11H21BO3
MolecularWeight: 212.0936
MdlNumber: MFCD00667560
Smiles: CC1(C)OB(OC1(C)C)C1CCOCC1
Complexity: 218
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 3
RotatableBondCount: 1
CatalogNumber:
AB50425
ChemicalName:
Tetrahydropyran-4-boronic acid, pinacol ester
CasNumber:
1131912-76-9
MolecularFormula:
C11H21BO3
MolecularWeight:
212.0936
MdlNumber:
MFCD00667560
Smiles:
CC1(C)OB(OC1(C)C)C1CCOCC1
Complexity:
218
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
3
RotatableBondCount:
1
CatalogNumber: AB50426
ChemicalName: 5-Nitro-2-((3-phenylpropyl)amino)benzoic acid
CasNumber: 107254-86-4
MolecularFormula: C16H16N2O4
MolecularWeight: 300.3092
MdlNumber: MFCD00153851
Smiles: OC(=O)c1cc(ccc1NCCCc1ccccc1)[N+](=O)[O-]
Complexity: 377
Covalently-bondedUnitCount: 1
HeavyAtomCount: 22
HydrogenBondAcceptorCount: 5
RotatableBondCount: 6
CatalogNumber:
AB50426
ChemicalName:
5-Nitro-2-((3-phenylpropyl)amino)benzoic acid
CasNumber:
107254-86-4
MolecularFormula:
C16H16N2O4
MolecularWeight:
300.3092
MdlNumber:
MFCD00153851
Smiles:
OC(=O)c1cc(ccc1NCCCc1ccccc1)[N+](=O)[O-]
Complexity:
377
Covalently-bondedUnitCount:
1
HeavyAtomCount:
22
HydrogenBondAcceptorCount:
5
RotatableBondCount:
6
CatalogNumber: AB50427
ChemicalName: 1-bromo-4-cyclopropylbenzene
CasNumber: 1124-14-7
MolecularFormula: C9H9Br
MolecularWeight: 197.0718
MdlNumber: MFCD00101828
Smiles: Brc1ccc(cc1)C1CC1
Complexity: 110
Covalently-bondedUnitCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: __
RotatableBondCount: 1
CatalogNumber:
AB50427
ChemicalName:
1-bromo-4-cyclopropylbenzene
CasNumber:
1124-14-7
MolecularFormula:
C9H9Br
MolecularWeight:
197.0718
MdlNumber:
MFCD00101828
Smiles:
Brc1ccc(cc1)C1CC1
Complexity:
110
Covalently-bondedUnitCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
__
RotatableBondCount:
1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: C[C@H](C(=O)OC)CC(=O)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
C[C@H](C(=O)OC)CC(=O)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__