AI44509
2019997-41-0 | 1-(Cyclopropylmethyl)pyrazole-5-boronic acid pinacol ester
Manufacturer: A2B Chem
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CatalogNumber
AI44509
ChemicalName
1-(Cyclopropylmethyl)pyrazole-5-boronic acid pinacol ester
CasNumber
2019997-41-0
MolecularFormula
C13H21BN2O2
MolecularWeight
248.129
MdlNumber
MFCD18250654
Smiles
CC1(C)OB(OC1(C)C)c1ccnn1CC1CC1
Complexity
315
Covalently-bondedUnitCount
1
HeavyAtomCount
18
HydrogenBondAcceptorCount
3
RotatableBondCount
3
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CatalogNumber: AI44509
ChemicalName: 1-(Cyclopropylmethyl)pyrazole-5-boronic acid pinacol ester
CasNumber: 2019997-41-0
MolecularFormula: C13H21BN2O2
MolecularWeight: 248.129
MdlNumber: MFCD18250654
Smiles: CC1(C)OB(OC1(C)C)c1ccnn1CC1CC1
Complexity: 315
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 3
RotatableBondCount: 3
CatalogNumber:
AI44509
ChemicalName:
1-(Cyclopropylmethyl)pyrazole-5-boronic acid pinacol ester
CasNumber:
2019997-41-0
MolecularFormula:
C13H21BN2O2
MolecularWeight:
248.129
MdlNumber:
MFCD18250654
Smiles:
CC1(C)OB(OC1(C)C)c1ccnn1CC1CC1
Complexity:
315
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
3
RotatableBondCount:
3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Cc1nc2c([nH]1)cc(cn2)B1OC(C(O1)(C)C)(C)C
Complexity: 348
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
CatalogNumber:
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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:
Cc1nc2c([nH]1)cc(cn2)B1OC(C(O1)(C)C)(C)C
Complexity:
348
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
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MolecularWeight: __
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Smiles: O=C(C(F)(F)F)/C=C/c1c(C)[nH]c2c1cccc2
Complexity: __
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HydrogenBondAcceptorCount: __
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:
O=C(C(F)(F)F)/C=C/c1c(C)[nH]c2c1cccc2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C(C(F)(F)F)/C=C/c1c([nH]c2c1cccc2)c1ccccc1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C(C(F)(F)F)/C=C/c1c([nH]c2c1cccc2)c1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__