W268100
对甲基苯甲醚
≥99%, FCC, FG
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关于此项目
线性分子式:
CH3C6H4OCH3
化学文摘社编号:
分子量:
122.16
FEMA Number:
2681
Council of Europe no.:
188
UNSPSC Code:
12164502
PubChem Substance ID:
Flavis number:
4.015
EC Number:
203-253-7
NACRES:
NA.21
MDL number:
Beilstein/REAXYS Number:
1237336
Organoleptic:
minty; camphoraceous; phenolic
Grade:
FG
Fragrance grade
Halal
Kosher
Fragrance grade
Halal
Kosher
Biological source:
synthetic
Agency:
follows IFRA guidelines
Food allergen:
no known allergens
产品名称
对甲基苯甲醚, ≥99%, FCC, FG
SMILES string
COc1ccc(C)cc1
InChI
1S/C8H10O/c1-7-3-5-8(9-2)6-4-7/h3-6H,1-2H3
InChI key
CHLICZRVGGXEOD-UHFFFAOYSA-N
biological source
synthetic
grade
FG
Fragrance grade
Halal
Kosher
agency
follows IFRA guidelines
reg. compliance
EU Regulation 1223/2009
EU Regulation 1334/2008 & 178/2002
FCC
FDA 21 CFR 117
FDA 21 CFR 172.515
vapor pressure
5.25 mmHg ( 50 °C)
assay
≥99%
refractive index
n20/D 1.511 (lit.)
bp
174 °C (lit.)
density
0.969 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
minty; camphoraceous; phenolic
Quality Level
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signalword
Warning
hcodes
Hazard Classifications
Acute Tox. 4 Oral - Flam. Liq. 3 - Repr. 2 - Skin Irrit. 2
存储类别
3 - Flammable liquids
wgk
WGK 2
flash_point_f
138.2 °F - closed cup
flash_point_c
59 °C - closed cup
ppe
Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
法规信息
危险化学品
此项目有
B Brunsborg et al.
Toxicology letters, 73(3), 209-212 (1994-09-01)
4-Methoxytoluene was given by gavage to 4 groups of 20 rats at dosage levels of 0, 40, 120 or 240 mg kg-1 body weight/day for 4 weeks. There was a statistically significant decrease in serum creatinine and urea in the
Occurrence of aromatic methyl migration (NIH-shift) during oxidation of p-methylanisole by hemin-thiolester complex as a cytochrome P-450 model.
H Sakurai et al.
Biochemical and biophysical research communications, 108(4), 1649-1654 (1982-10-29)
Jiangou Huang et al.
Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy, 67(3-4), 824-829 (2006-11-01)
One-color (1C), two-color (2C) resonant two-photon ionization (R2PI), and mass analyzed threshold ionization (MATI) methods have been applied to study the S(1)<--S(0) transition and threshold ionization of p-methylanisole. The excitation energy of the S(1)<--S(0) transition is determined to be 35,401+/-2
Alessandro Scarso et al.
Journal of the American Chemical Society, 125(46), 13981-13983 (2003-11-13)
Reversible coencapsulation of a solute molecule and a single solvent molecule takes place in solution at ambient temperature. Two isomeric complexes are formed (social isomers), and their relative energies are assessed by NMR methods. Intermolecular interactions between 3 aromatic solutes
L Higgins et al.
Archives of biochemistry and biophysics, 385(1), 220-230 (2001-05-22)
Regioselectivity is used to determine the absolute energetic differences for four different reactions catalyzed by P450. Abstraction of a hydrogen from a benzylic carbon containing a chlorine has a 1.0 kcal/mol lower barrier than abstraction from a simple benzylic carbon
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