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262595

Sigma-Aldrich

Perhydroisoquinoline

96%

Synonym(s):

Decahydroisoquinoline

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About This Item

Empirical Formula (Hill Notation):
C9H17N
CAS Number:
6329-61-9
Molecular Weight:
139.24
EC Number:
228-702-4
MDL number:
MFCD00012096
UNSPSC Code:
12352100
PubChem Substance ID:
24855879
NACRES:
NA.22

Assay

96%

composition

(mixture of cis and trans)

refractive index

n20/D 1.4904 (lit.)

bp

211-214 °C (lit.)

density

0.936 g/mL at 25 °C (lit.)

SMILES string

C1CCC2CNCCC2C1

InChI

1S/C9H17N/c1-2-4-9-7-10-6-5-8(9)3-1/h8-10H,1-7H2

InChI key

NENLYAQPNATJSU-UHFFFAOYSA-N

General description

Spectroscopic investigations of charge-transfer complexes of perhydroisoquinoline with 2,3-dichloro-5,6-dicyano-1,4-benzoquinone, p-chloranil and 7,7′,8,8′-tetracyanoquinodimethane has been reported.

Application

Perhydroisoquinoline has been used in the synthesis of nelfinavir mesylate.

Pictograms

Exclamation mark
GHS07

Signal Word

Warning

Hazard Statements

H315,H319,H335

Hazard Classifications

Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3

Target Organs

Respiratory system

Storage Class Code

10 - Combustible liquids

WGK

WGK 3

Flash Point(F)

174.2 °F - closed cup

Flash Point(C)

79 °C - closed cup

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Certificates of Analysis (COA)

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Spectroscopic and thermal studies on charge-transfer complexes of perhydroisoquinoline with p-chloranil, 2, 3-dichloro-5, 6-dicyano-1, 4-benzoquinone, and 7, 7', 8, 8'-tetracyanoquinodimethane.
Refat MS and Abou-Melha S.
Journal of Applied Spectroscopy, 79(1), 11-21 (2012)
Savithra Jayaraj et al.
Scientific reports, 9(1), 11280-11280 (2019-08-04)
Visible-light mediated aerobic dehydrogenation of N-heterocyclic compounds is a reaction with enormous potential for application. Herein, we report the first complete aerobic dehydrogenation pathway to large-scale production of isoquinolines. The discovery of this visible light photoredox reaction was enabled through
Thomas Körber et al.
Physical chemistry chemical physics : PCCP, 22(16), 9086-9097 (2020-04-18)
A series of high-Tg glass formers with Tg values varying between 347 and 390 K and molar masses in the range of 341 and 504 g mol-1 are investigated by dielectric spectroscopy. They are compared to paradigmatic reference systems. Differently
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Noncontact ratiometric fluorescent thermometers have received great interests in recent years. Besides being a sensitive and easily observable detection signal, the ratiometric dual fluorescence are also highly accurate and resistable to interference. However, organic molecular thermometers with such fluorescence property
Yelena Mostinski et al.
Journal of medicinal chemistry, 63(23), 14780-14804 (2020-11-20)
The tyrosine phosphatase SHP2 controls the activity of pivotal signaling pathways, including MAPK, JAK-STAT, and PI3K-Akt. Aberrant SHP2 activity leads to uncontrolled cell proliferation, tumorigenesis, and metastasis. SHP2 signaling was recently linked to drug resistance against cancer medications such as

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