AV18397
1704081-32-2 | (2-Methoxy-5-(n-methylsulfamoyl)phenyl)boronic acid
Manufacturer: A2B Chem
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CatalogNumber
AV18397
ChemicalName
(2-Methoxy-5-(n-methylsulfamoyl)phenyl)boronic acid
CasNumber
1704081-32-2
MolecularFormula
C8H12BNO5S
MolecularWeight
245.0606
MdlNumber
MFCD28400429
Smiles
COc1ccc(cc1B(O)O)S(=O)(=O)NC
Complexity
315
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
6
HydrogenBondDonorCount
3
RotatableBondCount
4
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CatalogNumber: AV18397
ChemicalName: (2-Methoxy-5-(n-methylsulfamoyl)phenyl)boronic acid
CasNumber: 1704081-32-2
MolecularFormula: C8H12BNO5S
MolecularWeight: 245.0606
MdlNumber: MFCD28400429
Smiles: COc1ccc(cc1B(O)O)S(=O)(=O)NC
Complexity: 315
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 3
RotatableBondCount: 4
CatalogNumber:
AV18397
ChemicalName:
(2-Methoxy-5-(n-methylsulfamoyl)phenyl)boronic acid
CasNumber:
1704081-32-2
MolecularFormula:
C8H12BNO5S
MolecularWeight:
245.0606
MdlNumber:
MFCD28400429
Smiles:
COc1ccc(cc1B(O)O)S(=O)(=O)NC
Complexity:
315
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
3
RotatableBondCount:
4
CatalogNumber: AV18398
ChemicalName: Methyl 2-hydroxy-2-(4-nitrophenyl)acetate
CasNumber: 13305-09-4
MolecularFormula: C9H9NO5
MolecularWeight: 211.1715
MdlNumber: MFCD29919631
Smiles: COC(=O)C(c1ccc(cc1)[N+](=O)[O-])O
Complexity: 241
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 3
CatalogNumber:
AV18398
ChemicalName:
Methyl 2-hydroxy-2-(4-nitrophenyl)acetate
CasNumber:
13305-09-4
MolecularFormula:
C9H9NO5
MolecularWeight:
211.1715
MdlNumber:
MFCD29919631
Smiles:
COC(=O)C(c1ccc(cc1)[N+](=O)[O-])O
Complexity:
241
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
3
CatalogNumber: AV18399
ChemicalName: 3-(Adamantan-1-yl)-6-bromonaphthalen-2-ol
CasNumber: 128272-29-7
MolecularFormula: C20H21BrO
MolecularWeight: 357.2841
MdlNumber: MFCD13182367
Smiles: Oc1cc2ccc(cc2cc1C12CC3CC(C2)CC(C1)C3)Br
Complexity: 406
Covalently-bondedUnitCount: 1
HeavyAtomCount: 22
HydrogenBondAcceptorCount: 1
HydrogenBondDonorCount: 1
RotatableBondCount: 1
CatalogNumber:
AV18399
ChemicalName:
3-(Adamantan-1-yl)-6-bromonaphthalen-2-ol
CasNumber:
128272-29-7
MolecularFormula:
C20H21BrO
MolecularWeight:
357.2841
MdlNumber:
MFCD13182367
Smiles:
Oc1cc2ccc(cc2cc1C12CC3CC(C2)CC(C1)C3)Br
Complexity:
406
Covalently-bondedUnitCount:
1
HeavyAtomCount:
22
HydrogenBondAcceptorCount:
1
HydrogenBondDonorCount:
1
RotatableBondCount:
1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
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Smiles: C#Cc1cccc(c1)NC(=O)OCC1c2ccccc2-c2c1cccc2
Complexity: 528
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
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:
C#Cc1cccc(c1)NC(=O)OCC1c2ccccc2-c2c1cccc2
Complexity:
528
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
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