Cinnamylamine hydrochloride, (E)-

HCID 6444486
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Basic information

CAS
17480-08-9
Standard SMILES
Cl.NC/C=C/c1ccccc1
InChIKey
RHJVYCBQGSIGEG-KQGICBIGSA-N
Molecular formula
C9H12ClN
Average molar mass
169.65 g/mol
Monoisotopic mass
169.0658271

Names & identifiers

Preferred name
Cinnamylamine hydrochloride, (E)-
IUPAC
(E)-3-phenylprop-2-en-1-amine;hydrochloride
English name
Cinnamylamine hydrochloride
Molecular weight
0

Names & synonyms

17480-08-9Cinnamylamine hydrochloride, (E)-Cinnamylamine, hydrochloride, (E)-18K2HTU6KP(2E)-3-phenylprop-2-en-1-amine hydrochloride2-Propen-1-amine, 3-phenyl-, hydrochloride (1:1), (2E)-RefChem:577227695-318-5837-674-85586-89-0CINNAMYLAMINE HYDROCHLORIDE3-phenylprop-2-en-1-amine hydrochloride
Show more names
[(E)-3-phenylprop-2-enyl]azaniumcinnamylamine hydrochlo (1672927)(2-E)-3-phenyl-2-propylene-1-aminehydrochlorideTranylcypromine Related Compound B DISCONTINUED. Please see C442090.Tranylcypromine Related Compound B (trans-3-phenylallylamine hydrochloride
CINNAMYLAMINE, HYDROCHLORIDE(E)-3-phenylprop-2-en-1-amine hydrochlorideMFCD00184831(E)-3-phenylprop-2-en-1-amine;hydrochloride(2E)-3-Phenyl-2-propen-1-amine hydrochloridetrans-cinnamylamine hydrochloride(E)-1-Amino-3-phenyl-2-propene Hydrochloride[(2E)-3-phenyl-2-propen-1-yl]amine hydrochloride

Database identifiers

CAS
17480-08-9、5586-89-0
PubChem CID
6444486
UNII
18K2HTU6KP
EC Number
695-318-5、837-674-8

Properties

Computed structural properties

Topological polar surface area
26 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
1
Rotatable bonds
2
Heavy atoms
11

Physicochemical properties

storage temp.
2 · 2-8°C
Major Application
pharmaceutical (small molecule)
InChI
1S/C9H11N.ClH/c10-8-4-7-9-5-2-1-3-6-9;/h1-7H,8,10H2;1H/b7-4+;
InChIKey
RHJVYCBQGSIGEG-KQGICBIGSA-N
SMILES
[Cl-].[N+H3]C\C=C\c1ccccc1
FDA UNII
18 K2HTU6KP · 18K2HTU6KP

Safety & regulation

GHS classification

GHS Classification · 6 items

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Hazard information

Hazard Classes and Categories · 2 items

Acute Tox. 4 (100%)；Skin Irrit. 2 (100%)；Eye Irrit. 2 (100%)；STOT SE 3 (100%)

Acute Tox. 4 (100%)；Skin Irrit. 2 (100%)；Eye Irrit. 2A (100%)；STOT SE 3 (100%)

Safety data

wgk
3
hs_code
2921490002
Signal word
Warning
Symbol(GHS)
GHS07
Storage Class
11 - Combustible Solids
Hazard statements
H302-H315-H319-H335

Chemistry & industry

Applications

UsesTranylcypromine Related Compound B is a useful reagent for the preparation of a novel lysophosphatidic acid receptor 1 antagonist.

Suppliers21 total

国药集团化学试剂有限公司86-21-63210123 · [email protected]
郑州汇聚化工有限公司0371-53399770 18037166334 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
上海健超生物科技有限公司150-2103-5486 18017383231 · [email protected]
Labnetwork lnc.+86-27-50766799 +86-18062016861 · [email protected]

Related reactions

2 records
New reaction record

Compound notes

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