2,4,5-Trimethylbenzonitrile - CAS 58260-83-6
Catalog: |
BB029992 |
Product Name: |
2,4,5-Trimethylbenzonitrile |
CAS: |
58260-83-6 |
Synonyms: |
2,4,5-trimethylbenzonitrile |
IUPAC Name: | 2,4,5-trimethylbenzonitrile |
Description: | 2,4,5-Trimethylbenzonitrile (CAS# 58260-83-6 ) is a useful research chemical. |
Molecular Weight: | 145.20 |
Molecular Formula: | C10H11N |
Canonical SMILES: | CC1=CC(=C(C=C1C#N)C)C |
InChI: | InChI=1S/C10H11N/c1-7-4-9(3)10(6-11)5-8(7)2/h4-5H,1-3H3 |
InChI Key: | VTCFOBGVVUVYHP-UHFFFAOYSA-N |
Boiling Point: | 271.7 ℃ at 760 mmHg |
Density: | 0.97 g/cm3 |
Appearance: | Solid |
MDL: | MFCD02683504 |
LogP: | 2.48348 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P312, P322, P330, P363, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2021047622-A1 | Pyridine oxynitride, preparation method therefor and use thereof | 20190912 |
DE-102018201548-A1 | Electrolytic composition for electrochemical cell for high temperature applications | 20180201 |
WO-2019149812-A1 | Electrolyte composition for electrochemical cell for high-temperature applications | 20180201 |
EP-3604983-A1 | Method for detecting location of refrigerant leak | 20170331 |
JP-2018173266-A | Method for detecting refrigerant leak location | 20170331 |
Complexity: | 177 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 145.089149355 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 145.089149355 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 23.8 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.7 |
Online Inquiry
Customer Support
Customer Centered
Related Functional Groups
Nitrogen Compounds
Customers Also Viewed
-
[35153-16-3]
(Z)-10-Tetradecenyl Acetate
-
[132182-92-4]
Pentane, 1,1,1,2,2,3,4,5,5,5-decafluoro-3-methoxy-4-(trifluoromethyl)-
-
[87117-22-4]
1,4-Bis(2-ethylhexyl)benzene
-
[56507-37-0]
Metribuzin-diketo
-
[21178-14-3]
N,N'-Dimethyl-2,7-diazapyrenium difluoroborate
-
[94086-78-9]
Isopropyl 4-[4-[N,N-bis(2-hydroxyethyl)amino]phenyl]butyrate
INDUSTRY LEADERS TRUST OUR PRODUCTS