AI58694
876918-90-0 | 3-Cyano-4-pyrrolidinophenylboronic acid
Manufacturer: A2B Chem
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CatalogNumber
AI58694
ChemicalName
3-Cyano-4-pyrrolidinophenylboronic acid
CasNumber
876918-90-0
MolecularFormula
C11H13BN2O2
MolecularWeight
216.0441
MdlNumber
MFCD27931158
Smiles
N#Cc1cc(ccc1N1CCCC1)B(O)O
Complexity
283
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
2
RotatableBondCount
2
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CatalogNumber: AI58694
ChemicalName: 3-Cyano-4-pyrrolidinophenylboronic acid
CasNumber: 876918-90-0
MolecularFormula: C11H13BN2O2
MolecularWeight: 216.0441
MdlNumber: MFCD27931158
Smiles: N#Cc1cc(ccc1N1CCCC1)B(O)O
Complexity: 283
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 2
CatalogNumber:
AI58694
ChemicalName:
3-Cyano-4-pyrrolidinophenylboronic acid
CasNumber:
876918-90-0
MolecularFormula:
C11H13BN2O2
MolecularWeight:
216.0441
MdlNumber:
MFCD27931158
Smiles:
N#Cc1cc(ccc1N1CCCC1)B(O)O
Complexity:
283
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
2
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MolecularFormula: __
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Smiles: CS[C@H]1CN([C@@H](C1)C(=O)O)C(=O)OC(C)(C)C
Complexity: __
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RotatableBondCount: __
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Smiles:
CS[C@H]1CN([C@@H](C1)C(=O)O)C(=O)OC(C)(C)C
Complexity:
__
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Smiles: Oc1ccc(cc1)C1=CCCC1
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Smiles:
Oc1ccc(cc1)C1=CCCC1
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HydrogenBondDonorCount:
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Smiles: ClCc1nc2ccccc2c(n1)N
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CatalogNumber:
__
ChemicalName:
__
CasNumber:
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MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
ClCc1nc2ccccc2c(n1)N
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__