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经验公式(希尔记法):
C7H9N
化学文摘社编号:
分子量:
107.15
NACRES:
NA.21
Flavis number:
14.104
UNSPSC Code:
12352100
FEMA Number:
4389
MDL number:
Beilstein/REAXYS Number:
1506
Organoleptic:
smoky; phenolic
Grade:
FG
Agency:
follows IFRA guidelines, meets purity specifications of JECFA
Food allergen:
no known allergens
InChI
1S/C7H9N/c1-6-3-4-8-7(2)5-6/h3-5H,1-2H3
SMILES string
Cc1ccnc(C)c1
InChI key
JYYNAJVZFGKDEQ-UHFFFAOYSA-N
grade
FG
agency
follows IFRA guidelines, meets purity specifications of JECFA
reg. compliance
EU 1223/2009, EU 1334/2008 & 178/2002, FDA 21 CFR 117
assay
≥98%
Quality Level
bp
159 °C (lit.)
mp
−60 °C (lit.)
density
0.927 g/mL at 25 °C (lit.)
application(s)
flavors and fragrances
documentation
see Safety & Documentation for available documents
food allergen
no known allergens
fragrance allergen
no known allergens
organoleptic
smoky; phenolic
signalword
Danger
Hazard Classifications
Acute Tox. 3 Dermal - Acute Tox. 3 Inhalation - Acute Tox. 3 Oral - Eye Irrit. 2 - Flam. Liq. 3 - Skin Irrit. 2 - STOT SE 3
target_organs
Respiratory system
存储类别
3 - Flammable liquids
wgk
WGK 3
flash_point_f
116.6 °F - closed cup
flash_point_c
47 °C - closed cup
法规信息
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