AA74974
149793-69-1 | 3-Fluoro-5-trifluoromethylbenzonitrile
Manufacturer: A2B Chem
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CatalogNumber
AA74974
ChemicalName
3-Fluoro-5-trifluoromethylbenzonitrile
CasNumber
149793-69-1
MolecularFormula
C8H3F4N
MolecularWeight
189.1097
MdlNumber
MFCD00061282
Smiles
N#Cc1cc(F)cc(c1)C(F)(F)F
Complexity
226
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
5
Xlogp3
2.6
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CatalogNumber: AA74974
ChemicalName: 3-Fluoro-5-trifluoromethylbenzonitrile
CasNumber: 149793-69-1
MolecularFormula: C8H3F4N
MolecularWeight: 189.1097
MdlNumber: MFCD00061282
Smiles: N#Cc1cc(F)cc(c1)C(F)(F)F
Complexity: 226
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 5
Xlogp3: 2.6
CatalogNumber:
AA74974
ChemicalName:
3-Fluoro-5-trifluoromethylbenzonitrile
CasNumber:
149793-69-1
MolecularFormula:
C8H3F4N
MolecularWeight:
189.1097
MdlNumber:
MFCD00061282
Smiles:
N#Cc1cc(F)cc(c1)C(F)(F)F
Complexity:
226
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
5
Xlogp3:
2.6
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Cc1ccc(cc1)/C=C/B1OC(C(O1)(C)C)(C)C
Complexity: 299
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Cc1ccc(cc1)/C=C/B1OC(C(O1)(C)C)(C)C
Complexity:
299
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COc1ccc(cc1)/C=C/B1OC(C(O1)(C)C)(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COc1ccc(cc1)/C=C/B1OC(C(O1)(C)C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
Xlogp3:
__
CatalogNumber: AA74979
ChemicalName: Dimethyl tetrahydropyran-4-dicarboxylate
CasNumber: 149777-00-4
MolecularFormula: C9H14O5
MolecularWeight: 202.2045
MdlNumber: MFCD02093499
Smiles: COC(=O)C1(CCOCC1)C(=O)OC
Complexity: 211
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 5
Xlogp3: 0.3
CatalogNumber:
AA74979
ChemicalName:
Dimethyl tetrahydropyran-4-dicarboxylate
CasNumber:
149777-00-4
MolecularFormula:
C9H14O5
MolecularWeight:
202.2045
MdlNumber:
MFCD02093499
Smiles:
COC(=O)C1(CCOCC1)C(=O)OC
Complexity:
211
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
5
Xlogp3:
0.3