AA44348
1287777-05-2 | 3-(Tetrahydropyran-2-yloxy)phenylboronic acid
Manufacturer: A2B Chem
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CatalogNumber
AA44348
ChemicalName
3-(Tetrahydropyran-2-yloxy)phenylboronic acid
CasNumber
1287777-05-2
MolecularFormula
C11H15BO4
MolecularWeight
222.0454
MdlNumber
MFCD03425971
Smiles
OB(c1cccc(c1)OC1CCCCO1)O
Complexity
212
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
2
RotatableBondCount
3
UndefinedAtomStereocenterCount
1
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CatalogNumber: AA44348
ChemicalName: 3-(Tetrahydropyran-2-yloxy)phenylboronic acid
CasNumber: 1287777-05-2
MolecularFormula: C11H15BO4
MolecularWeight: 222.0454
MdlNumber: MFCD03425971
Smiles: OB(c1cccc(c1)OC1CCCCO1)O
Complexity: 212
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 3
UndefinedAtomStereocenterCount: 1
CatalogNumber:
AA44348
ChemicalName:
3-(Tetrahydropyran-2-yloxy)phenylboronic acid
CasNumber:
1287777-05-2
MolecularFormula:
C11H15BO4
MolecularWeight:
222.0454
MdlNumber:
MFCD03425971
Smiles:
OB(c1cccc(c1)OC1CCCCO1)O
Complexity:
212
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
3
UndefinedAtomStereocenterCount:
1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(c1cccc(c1)B(O)O)C
Complexity: 152
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(c1cccc(c1)B(O)O)C
Complexity:
152
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
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ChemicalName: __
CasNumber: __
MolecularFormula: __
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Smiles: Cc1nccc(c1)c1occ(n1)C(=O)Nc1cn(nc1C(=O)N)C1CCOCC1.Cl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
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__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Cc1nccc(c1)c1occ(n1)C(=O)Nc1cn(nc1C(=O)N)C1CCOCC1.Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: NCc1nccc(c1)CO
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
NCc1nccc(c1)CO
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__