AV18581
866625-02-7 | 4-Chloro-2-(methoxycarbonyl)phenylboronic acid pinacol ester
Manufacturer: A2B Chem
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CatalogNumber
AV18581
ChemicalName
4-Chloro-2-(methoxycarbonyl)phenylboronic acid pinacol ester
CasNumber
866625-02-7
MolecularFormula
C14H18BClO4
MolecularWeight
296.5543
MdlNumber
MFCD16996244
Smiles
COC(=O)c1cc(Cl)ccc1B1OC(C(O1)(C)C)(C)C
Complexity
369
Covalently-bondedUnitCount
1
HeavyAtomCount
20
HydrogenBondAcceptorCount
4
RotatableBondCount
3
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CatalogNumber: AV18581
ChemicalName: 4-Chloro-2-(methoxycarbonyl)phenylboronic acid pinacol ester
CasNumber: 866625-02-7
MolecularFormula: C14H18BClO4
MolecularWeight: 296.5543
MdlNumber: MFCD16996244
Smiles: COC(=O)c1cc(Cl)ccc1B1OC(C(O1)(C)C)(C)C
Complexity: 369
Covalently-bondedUnitCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 4
RotatableBondCount: 3
CatalogNumber:
AV18581
ChemicalName:
4-Chloro-2-(methoxycarbonyl)phenylboronic acid pinacol ester
CasNumber:
866625-02-7
MolecularFormula:
C14H18BClO4
MolecularWeight:
296.5543
MdlNumber:
MFCD16996244
Smiles:
COC(=O)c1cc(Cl)ccc1B1OC(C(O1)(C)C)(C)C
Complexity:
369
Covalently-bondedUnitCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
4
RotatableBondCount:
3
CatalogNumber: AV18582
ChemicalName: 1-(5-Chloro-2-methylphenyl)propan-1-ol
CasNumber: 1314976-74-3
MolecularFormula: C10H13ClO
MolecularWeight: 184.6626
MdlNumber: MFCD11521240
Smiles: Cc1ccc(cc1C(CC)O)Cl
Complexity: 138
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 1
RotatableBondCount: 2
CatalogNumber:
AV18582
ChemicalName:
1-(5-Chloro-2-methylphenyl)propan-1-ol
CasNumber:
1314976-74-3
MolecularFormula:
C10H13ClO
MolecularWeight:
184.6626
MdlNumber:
MFCD11521240
Smiles:
Cc1ccc(cc1C(CC)O)Cl
Complexity:
138
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
1
RotatableBondCount:
2
CatalogNumber: AV18583
ChemicalName: 2-(Phenylsulfonyl)nicotinaldehyde
CasNumber: 1161864-92-1
MolecularFormula: C12H9NO3S
MolecularWeight: 247.2698
MdlNumber: MFCD29917041
Smiles: O=Cc1cccnc1S(=O)(=O)c1ccccc1
Complexity: 354
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 4
RotatableBondCount: 3
CatalogNumber:
AV18583
ChemicalName:
2-(Phenylsulfonyl)nicotinaldehyde
CasNumber:
1161864-92-1
MolecularFormula:
C12H9NO3S
MolecularWeight:
247.2698
MdlNumber:
MFCD29917041
Smiles:
O=Cc1cccnc1S(=O)(=O)c1ccccc1
Complexity:
354
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
4
RotatableBondCount:
3
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Smiles: CC(c1nnc2n1cccc2)N.Cl.Cl
Complexity: __
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Smiles:
CC(c1nnc2n1cccc2)N.Cl.Cl
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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