AG16765
56052-26-7 | 1-Bromo-4-hydroxymethylnaphthalene
Manufacturer: A2B Chem
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CatalogNumber
AG16765
ChemicalName
1-Bromo-4-hydroxymethylnaphthalene
CasNumber
56052-26-7
MolecularFormula
C11H9BrO
MolecularWeight
237.0926
MdlNumber
MFCD06658378
Smiles
OCc1ccc(c2c1cccc2)Br
Complexity
172
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
1
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
3
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CatalogNumber: AG16765
ChemicalName: 1-Bromo-4-hydroxymethylnaphthalene
CasNumber: 56052-26-7
MolecularFormula: C11H9BrO
MolecularWeight: 237.0926
MdlNumber: MFCD06658378
Smiles: OCc1ccc(c2c1cccc2)Br
Complexity: 172
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 1
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 3
CatalogNumber:
AG16765
ChemicalName:
1-Bromo-4-hydroxymethylnaphthalene
CasNumber:
56052-26-7
MolecularFormula:
C11H9BrO
MolecularWeight:
237.0926
MdlNumber:
MFCD06658378
Smiles:
OCc1ccc(c2c1cccc2)Br
Complexity:
172
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
1
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(=O)CC(=O)c1ccccc1OC
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=O)CC(=O)c1ccccc1OC
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C(c1cc(cc(c1)N(=O)=O)N(=O)=O)OC(C)(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C(c1cc(cc(c1)N(=O)=O)N(=O)=O)OC(C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AG16768
ChemicalName: Methyl (4-cyanophenyl)acetate
CasNumber: 52798-01-3
MolecularFormula: C10H9NO2
MolecularWeight: 175.184
MdlNumber: MFCD02181140
Smiles: COC(=O)Cc1ccc(cc1)C#N
Complexity: 220
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: __
RotatableBondCount: 3
Xlogp3: 1.5
CatalogNumber:
AG16768
ChemicalName:
Methyl (4-cyanophenyl)acetate
CasNumber:
52798-01-3
MolecularFormula:
C10H9NO2
MolecularWeight:
175.184
MdlNumber:
MFCD02181140
Smiles:
COC(=O)Cc1ccc(cc1)C#N
Complexity:
220
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
__
RotatableBondCount:
3
Xlogp3:
1.5