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S9511548

1.0?mg/mLinacetonitrile,ampuleof1?mL,certifiedreferencematerial,Cerilliant? , 71267-22-6

Synonym(s):
NAT

CAS NO.:71267-22-6

Empirical Formula: C10H11N3O

Molecular Weight: 189.21

MDL number: MFCD01632691

EINECS: 690-329-1

Pack Size Price Stock Quantity
1mL RMB2116.48 In Stock
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Update time: 2022-07-08

PRODUCT Properties

Boiling point: 324.47°C (rough estimate)
Density  1.1654 (rough estimate)
refractive index  1.4830 (estimate)
Flash point: 2℃
storage temp.  -20°C
solubility  Chloroform (Slightly), Methanol (Slightly)
pka 5.06±0.12(Predicted)
form  Oil
color  Pale Yellow to Brown
Stability: Light Sensitive
Major Application forensics and toxicology
InChI 1S/C10H11N3O/c14-12-13-7-2-1-5-10(13)9-4-3-6-11-8-9/h1-4,6,8,10H,5,7H2/t10-/m0/s1
InChIKey ZJOFAFWTOKDIFH-JTQLQIEISA-N
SMILES N1([C@@H](CC=CC1)c2cnccc2)N=O
CAS DataBase Reference 71267-22-6(CAS DataBase Reference)
IARC 3 (Vol. 37, Sup 7, 89) 2007

Description and Uses

The S-enantiomer metabolite of tobacco, a specific N-nitrosamines with carcinogenic activity.

Safety

Symbol(GHS) 
GHS02,GHS07
Signal word  Danger
Hazard statements  H225-H302+H332-H319
Precautionary statements  P210-P305+P351+P338
RIDADR  UN 1648 3 / PGII
WGK Germany  2
Storage Class 3 - Flammable liquids
Hazard Classifications Acute Tox. 4 Dermal
Acute Tox. 4 Inhalation
Acute Tox. 4 Oral
Eye Irrit. 2
Flam. Liq. 2

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