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About This Item
Empirical Formula (Hill Notation):
C7H13N
CAS Number:
Molecular Weight:
111.18
EC Number:
202-887-1
UNSPSC Code:
12352100
PubChem Substance ID:
Beilstein/REAXYS Number:
103111
MDL number:
vapor pressure
1.5 mmHg ( 20 °C)
grade
purum
assay
≥97.0% (NT)
mp
155-160 °C, 157-160 °C (lit.)
SMILES string
C1CN2CCC1CC2
InChI
1S/C7H13N/c1-4-8-5-2-7(1)3-6-8/h7H,1-6H2
InChI key
SBYHFKPVCBCYGV-UHFFFAOYSA-N
Gene Information
rat ... Chrm1(25229)
signalword
Danger
hcodes
Hazard Classifications
Acute Tox. 2 Dermal - Acute Tox. 3 Oral - Eye Dam. 1 - Skin Irrit. 2
Storage Class
6.1B - Non-combustible acute toxic Cat. 1 and 2 / very toxic hazardous materials
wgk
WGK 3
flash_point_f
Not applicable
flash_point_c
Not applicable
ppe
Eyeshields, Faceshields, Gloves, type P2 (EN 143) respirator cartridges
Regulatory Information
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Werner J Geldenhuys et al.
Bioorganic & medicinal chemistry letters, 20(16), 4870-4877 (2010-07-20)
The high affinity neuronal choline transporter (CHT1) is responsible for the uptake of choline into the pre-synaptic terminal of cholinergic neurons. Considering our past experience with modeling the blood-brain barrier choline transporter (BBBCHT) as drug delivery vector to the CNS

