AI44597
2040476-06-8 | 4-(Dimethylaminomethyl)-2-fluorophenylboronic acid, pinacol ester
Manufacturer: A2B Chem
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CatalogNumber
AI44597
ChemicalName
4-(Dimethylaminomethyl)-2-fluorophenylboronic acid, pinacol ester
CasNumber
2040476-06-8
MolecularFormula
C15H23BFNO2
MolecularWeight
279.158
MdlNumber
MFCD18732706
Smiles
CN(Cc1ccc(c(c1)F)B1OC(C(O1)(C)C)(C)C)C
Complexity
333
Covalently-bondedUnitCount
1
HeavyAtomCount
20
HydrogenBondAcceptorCount
4
RotatableBondCount
3
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CatalogNumber: AI44597
ChemicalName: 4-(Dimethylaminomethyl)-2-fluorophenylboronic acid, pinacol ester
CasNumber: 2040476-06-8
MolecularFormula: C15H23BFNO2
MolecularWeight: 279.158
MdlNumber: MFCD18732706
Smiles: CN(Cc1ccc(c(c1)F)B1OC(C(O1)(C)C)(C)C)C
Complexity: 333
Covalently-bondedUnitCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 4
RotatableBondCount: 3
CatalogNumber:
AI44597
ChemicalName:
4-(Dimethylaminomethyl)-2-fluorophenylboronic acid, pinacol ester
CasNumber:
2040476-06-8
MolecularFormula:
C15H23BFNO2
MolecularWeight:
279.158
MdlNumber:
MFCD18732706
Smiles:
CN(Cc1ccc(c(c1)F)B1OC(C(O1)(C)C)(C)C)C
Complexity:
333
Covalently-bondedUnitCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
4
RotatableBondCount:
3
CatalogNumber: __
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MolecularFormula: __
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Smiles: O=C(N[C@@H](C1CCN(CC1)C(=O)OC(C)(C)C)C(=O)O)OCC1c2ccccc2-c2c1cccc2
Complexity: __
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Smiles:
O=C(N[C@@H](C1CCN(CC1)C(=O)OC(C)(C)C)C(=O)O)OCC1c2ccccc2-c2c1cccc2
Complexity:
__
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Smiles: C=CCOC(=O)[C@H](Cc1c[nH]c2c1cccc2)N.Cl
Complexity: __
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Smiles:
C=CCOC(=O)[C@H](Cc1c[nH]c2c1cccc2)N.Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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RotatableBondCount:
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Smiles: OC(=O)[C@H](NC(=O)OC(C)(C)C)CCCNC(=N)N.Cl.O
Complexity: 345
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:
OC(=O)[C@H](NC(=O)OC(C)(C)C)CCCNC(=N)N.Cl.O
Complexity:
345
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__