AF59403
405937-98-6 | 3-(3,5-Difluorophenyl)propenol
Manufacturer: A2B Chem
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CatalogNumber
AF59403
ChemicalName
3-(3,5-Difluorophenyl)propenol
CasNumber
405937-98-6
MolecularFormula
C9H8F2O
MolecularWeight
170.156
MdlNumber
MFCD09800440
Smiles
OC/C=C/c1cc(F)cc(c1)F
Complexity
149
Covalently-bondedUnitCount
1
DefinedBondStereocenterCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
1.9
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CatalogNumber: AF59403
ChemicalName: 3-(3,5-Difluorophenyl)propenol
CasNumber: 405937-98-6
MolecularFormula: C9H8F2O
MolecularWeight: 170.156
MdlNumber: MFCD09800440
Smiles: OC/C=C/c1cc(F)cc(c1)F
Complexity: 149
Covalently-bondedUnitCount: 1
DefinedBondStereocenterCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 1.9
CatalogNumber:
AF59403
ChemicalName:
3-(3,5-Difluorophenyl)propenol
CasNumber:
405937-98-6
MolecularFormula:
C9H8F2O
MolecularWeight:
170.156
MdlNumber:
MFCD09800440
Smiles:
OC/C=C/c1cc(F)cc(c1)F
Complexity:
149
Covalently-bondedUnitCount:
1
DefinedBondStereocenterCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
1.9
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCCCC1CCC(CC1)C2=CC=C(C=C2)C#CC3=CC=C(C=C3)OC
Complexity: __
Covalently-bondedUnitCount: __
DefinedBondStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCCCC1CCC(CC1)C2=CC=C(C=C2)C#CC3=CC=C(C=C3)OC
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedBondStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COc1cccc(c1)CC(C(=O)O)NC(=O)C
Complexity: __
Covalently-bondedUnitCount: __
DefinedBondStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COc1cccc(c1)CC(C(=O)O)NC(=O)C
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedBondStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AF59408
ChemicalName: 5-Ethyl-4-methylthiazole
CasNumber: 31883-01-9
MolecularFormula: C6H9NS
MolecularWeight: 127.20736
MdlNumber: MFCD09834442
Smiles: CCc1scnc1C
Complexity: 74.9
Covalently-bondedUnitCount: 1
DefinedBondStereocenterCount: __
HeavyAtomCount: 8
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: __
RotatableBondCount: 1
Xlogp3: 2.1
CatalogNumber:
AF59408
ChemicalName:
5-Ethyl-4-methylthiazole
CasNumber:
31883-01-9
MolecularFormula:
C6H9NS
MolecularWeight:
127.20736
MdlNumber:
MFCD09834442
Smiles:
CCc1scnc1C
Complexity:
74.9
Covalently-bondedUnitCount:
1
DefinedBondStereocenterCount:
__
HeavyAtomCount:
8
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
__
RotatableBondCount:
1
Xlogp3:
2.1