AI28892
127905-39-9 | 2-(2,5-Dimethoxyphenylthio)benzaldehyde
Manufacturer: A2B Chem
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CatalogNumber
AI28892
ChemicalName
2-(2,5-Dimethoxyphenylthio)benzaldehyde
CasNumber
127905-39-9
MolecularFormula
C15H14O3S
MolecularWeight
274.3349
MdlNumber
MFCD14585438
Smiles
COc1ccc(c(c1)Sc1ccccc1C=O)OC
Complexity
285
Covalently-bondedUnitCount
1
HeavyAtomCount
19
HydrogenBondAcceptorCount
4
RotatableBondCount
5
Xlogp3
3.4
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CatalogNumber: AI28892
ChemicalName: 2-(2,5-Dimethoxyphenylthio)benzaldehyde
CasNumber: 127905-39-9
MolecularFormula: C15H14O3S
MolecularWeight: 274.3349
MdlNumber: MFCD14585438
Smiles: COc1ccc(c(c1)Sc1ccccc1C=O)OC
Complexity: 285
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 4
RotatableBondCount: 5
Xlogp3: 3.4
CatalogNumber:
AI28892
ChemicalName:
2-(2,5-Dimethoxyphenylthio)benzaldehyde
CasNumber:
127905-39-9
MolecularFormula:
C15H14O3S
MolecularWeight:
274.3349
MdlNumber:
MFCD14585438
Smiles:
COc1ccc(c(c1)Sc1ccccc1C=O)OC
Complexity:
285
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
4
RotatableBondCount:
5
Xlogp3:
3.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C(NC1(COC1)c1ccc(cc1)Br)OC(C)(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
O=C(NC1(COC1)c1ccc(cc1)Br)OC(C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AI28894
ChemicalName: 2-(4-Iodophenyl)-4,4,6-trimethyl-1,3,2-dioxaborinane
CasNumber: 1279115-53-5
MolecularFormula: C12H16BIO2
MolecularWeight: 329.9697
MdlNumber: MFCD28101505
Smiles: CC1OB(OC(C1)(C)C)c1ccc(cc1)I
Complexity: 239
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 2
RotatableBondCount: 1
Xlogp3: __
CatalogNumber:
AI28894
ChemicalName:
2-(4-Iodophenyl)-4,4,6-trimethyl-1,3,2-dioxaborinane
CasNumber:
1279115-53-5
MolecularFormula:
C12H16BIO2
MolecularWeight:
329.9697
MdlNumber:
MFCD28101505
Smiles:
CC1OB(OC(C1)(C)C)c1ccc(cc1)I
Complexity:
239
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
2
RotatableBondCount:
1
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: C1CC(C1)c1nc2c(s1)cccc2
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
C1CC(C1)c1nc2c(s1)cccc2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__