4-tert-Butyl-o-xylene - CAS 7397-06-0
Catalog: |
BB034963 |
Product Name: |
4-tert-Butyl-o-xylene |
CAS: |
7397-06-0 |
Synonyms: |
4-tert-butyl-1,2-dimethylbenzene |
IUPAC Name: | 4-tert-butyl-1,2-dimethylbenzene |
Description: | 4-tert-Butyl-o-xylene (CAS# 7397-06-0) is a useful research chemical compound. |
Molecular Weight: | 162.27 |
Molecular Formula: | C12H18 |
Canonical SMILES: | CC1=C(C=C(C=C1)C(C)(C)C)C |
InChI: | InChI=1S/C12H18/c1-9-6-7-11(8-10(9)2)12(3,4)5/h6-8H,1-5H3 |
InChI Key: | QRPPSTNABSMSCS-UHFFFAOYSA-N |
Boiling Point: | 206-209 °C (737 torr) |
MDL: | MFCD00038277 |
LogP: | 3.60090 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
US-2015234274-A1 | Resist top-coat composition and patterning process | 20140214 |
US-2015234278-A1 | Patterning process | 20140214 |
WO-2014153001-A1 | Combination therapy for treating cancer | 20130314 |
WO-2014033223-A1 | New platinum(ii) complexes as triplet emitters for oled applications | 20120831 |
US-2013184282-A1 | Ip receptor agonist heterocyclic compounds | 20120113 |
Complexity: | 141 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 162.140850574 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 0 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 162.140850574 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 0 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 4.3 |
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