AA00280
1000339-94-5 | 3-Chloro-4-(trifluoromethoxy)phenol
Manufacturer: A2B Chem
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CatalogNumber
AA00280
ChemicalName
3-Chloro-4-(trifluoromethoxy)phenol
CasNumber
1000339-94-5
MolecularFormula
C7H4ClF3O2
MolecularWeight
212.5537
MdlNumber
MFCD04972754
Smiles
Oc1ccc(c(c1)Cl)OC(F)(F)F
Complexity
174
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
3.6
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CatalogNumber: AA00280
ChemicalName: 3-Chloro-4-(trifluoromethoxy)phenol
CasNumber: 1000339-94-5
MolecularFormula: C7H4ClF3O2
MolecularWeight: 212.5537
MdlNumber: MFCD04972754
Smiles: Oc1ccc(c(c1)Cl)OC(F)(F)F
Complexity: 174
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 3.6
CatalogNumber:
AA00280
ChemicalName:
3-Chloro-4-(trifluoromethoxy)phenol
CasNumber:
1000339-94-5
MolecularFormula:
C7H4ClF3O2
MolecularWeight:
212.5537
MdlNumber:
MFCD04972754
Smiles:
Oc1ccc(c(c1)Cl)OC(F)(F)F
Complexity:
174
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
3.6
CatalogNumber: AA00281
ChemicalName: 4-Fluoro-2-(hydroxymethyl)benzonitrile
CasNumber: 1000339-93-4
MolecularFormula: C8H6FNO
MolecularWeight: 151.1377
MdlNumber: MFCD09864693
Smiles: OCc1cc(F)ccc1C#N
Complexity: 174
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 0.9
CatalogNumber:
AA00281
ChemicalName:
4-Fluoro-2-(hydroxymethyl)benzonitrile
CasNumber:
1000339-93-4
MolecularFormula:
C8H6FNO
MolecularWeight:
151.1377
MdlNumber:
MFCD09864693
Smiles:
OCc1cc(F)ccc1C#N
Complexity:
174
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
0.9
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: N#CCc1cc(ccc1F)[N+](=O)[O-]
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
N#CCc1cc(ccc1F)[N+](=O)[O-]
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: BrCc1sc(nc1C(F)(F)F)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
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MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
BrCc1sc(nc1C(F)(F)F)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__