1-Phenylcyclobutanecarbonitrile - CAS 14377-68-5
Catalog: |
BB009666 |
Product Name: |
1-Phenylcyclobutanecarbonitrile |
CAS: |
14377-68-5 |
Synonyms: |
1-phenyl-1-cyclobutanecarbonitrile; 1-phenylcyclobutane-1-carbonitrile |
IUPAC Name: | 1-phenylcyclobutane-1-carbonitrile |
Description: | 1-Phenylcyclobutanecarbonitrile (CAS# 14377-68-5) is used as a reactant in the preparation of a novel diacylglycerol acyltransferase-1 (DGAT-1) inhibitor. |
Molecular Weight: | 157.21 |
Molecular Formula: | C11H11N |
Canonical SMILES: | C1CC(C1)(C#N)C2=CC=CC=C2 |
InChI: | InChI=1S/C11H11N/c12-9-11(7-4-8-11)10-5-2-1-3-6-10/h1-3,5-6H,4,7-8H2 |
InChI Key: | DHIDUDPFTZJPCQ-UHFFFAOYSA-N |
Boiling Point: | 290.9 ℃ at 760 mmHg |
Density: | 1.03 g/cm3 |
MDL: | MFCD00019258 |
LogP: | 2.63188 |
GHS Hazard Statement: | H302+H312+H332 (50%): Harmful if swallowed, in contact with skin or if inhaled [Warning Acute toxicity, oral; acute toxicity, dermal; acute toxicity, inhalation] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-113061098-A | Amide compound and derivative thereof, preparation method, pharmaceutical composition and application | 20210118 |
CN-108623425-A | A kind of method that four-membered ring is constructed in visible light catalytic [2+2] reaction | 20170322 |
US-2020345700-A1 | Lsd1 inhibitor and preparation method and application thereof | 20170124 |
US-2017312273-A1 | Methods of using fasn inhibitors | 20160425 |
WO-2017189613-A1 | Methods of using fasn inhibitors | 20160425 |
Complexity: | 200 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 157.089149355 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 157.089149355 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 23.8 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.5 |
Online Inquiry
Customer Support
Customer Centered
Related Functional Groups
Nitrogen Compounds
Customers Also Viewed
INDUSTRY LEADERS TRUST OUR PRODUCTS