4,5-Difluoro-2-methylbenzonitrile - CAS 1003708-82-4
Catalog: |
BB000203 |
Product Name: |
4,5-Difluoro-2-methylbenzonitrile |
CAS: |
1003708-82-4 |
Synonyms: |
4,5-difluoro-2-methylbenzonitrile; 4,5-difluoro-2-methylbenzonitrile |
IUPAC Name: | 4,5-difluoro-2-methylbenzonitrile |
Description: | 4,5-Difluoro-2-methylbenzonitrile (CAS# 1003708-82-4) is a useful research chemical. |
Molecular Weight: | 153.13 |
Molecular Formula: | C8H5F2N |
Canonical SMILES: | CC1=CC(=C(C=C1C#N)F)F |
InChI: | InChI=1S/C8H5F2N/c1-5-2-7(9)8(10)3-6(5)4-11/h2-3H,1H3 |
InChI Key: | NEUWJWYFYDQUMY-UHFFFAOYSA-N |
Boiling Point: | 214.288 °C at 760 mmHg |
Density: | 1.217 g/cm3 |
Appearance: | W hite powder |
Storage: | Sealed in dry, Room Temperature |
LogP: | 2.14488 |
Publication Number | Title | Priority Date |
WO-2018089433-A1 | PHENYL mTORC INHIBITORS AND USES THEREOF | 20161108 |
WO-2018089493-A1 | PYRROLE mTORC INHIBITORS AND USES THEREOF | 20161108 |
WO-2018089499-A1 | PHENYL AMINO PIPERIDINE mTORC INHIBITORS AND USES THEREOF | 20161108 |
WO-2017004608-A1 | Oxadiazole modulators of s1p methods of making and using | 20150702 |
EP-2729468-A2 | Tricyclic heterocycles useful as dipeptidyl peptidase-iv inhibitors | 20110705 |
Complexity: | 184 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 153.03900549 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 153.03900549 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 23.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.2 |
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