1,2-二甲基萘 | 573-98-8
中文名称:
1,2-二甲基萘
英文名称:
1,2-Dimethylnaphthalene
CAS No.:
573-98-8
分子式:
C1 2 H1 2
分子量:
156.2237
名称和标识符
MDL
MFCD00004035
InChIKey
QNLZIZAQLLYXTC-UHFFFAOYSA-N
Inchi
1S/C12H12/c1-9-7-8-11-5-3-4-6-12(11)10(9)2/h3-8H,1-2H3
SMILES
C12=C([H])C([H])=C([H])C([H])=C1C([H])=C([H])C(C([H])([H])[H])=C2C([H])([H])[H]
BRN
2039376
别名信息
- 中文别名 -
1,2-二甲基萘
1.2-二甲基萘
1,2-Dimethylnaphthalene 1,2-二甲基萘
O-(6-氯苯并三氮唑-1-基)-N,N,N',N'-四甲基脲四氟硼酸酯
1,2-二甲基萘 标准品
- 英文别名 -
1,2-dimethylnaphthalene
Dimethylnaphthalene
1,2-Dimethylnaphthalene Solution
1,2-Dimethylnaphthalene1000µg
Naphthalene, dimethyl-
Naphthalene, 1,2-dimethyl-
1,2-Dimethyl naphthalene
1,2-DMN
1,2-Dimethyl-naphthalene
QNLZIZAQLLYXTC-UHFFFAOYSA-N
23T7O135BD
DSSTox_CID_5130
DSSTox_RID_77675
DSSTox_GSID_25130
1,2-Dimethylnapthalene
Naphthalene,2-dimethyl-
Dimethylnaphthalene(mixture)
Naphthalene,1,2-dimethyl-
BIDD:ER0550
DT
FT-0606428
CAS-28804-88-8
D89712
1,2-DIMETHYLNAPHTHALENE
DIMETHYLNAPHTHALENE
NCGC00257181-01
NCGC00091381-01
NSC 59832
CS-0204519
CHEBI:34052
EINECS 209-364-7
1,2-Dimethylnaphthalene, 98%
NCGC00259716-01
D0747
AS-0224
Q27115775
AKOS015842353
1,2-Dimethylnaphthalene, analytical standard
Tox21_303140
NS00005181
CHEMBL382541
EINECS 249-241-5
NSC-59832
BDBM50159280
UNII-23T7O135BD
1,2-Dimethylnaphthalene, 95%
MFCD00004035
DTXSID1058717
NSC59832
Tox21_202167
573-98-8
SY049925
物化性质
实验特性
LogP
3.45660
PSA
0.00000
折射率
n20/D 1.615(lit.)
水溶性
Difficult to mix in water.
沸点
132°C/12mmHg(lit.)
熔点
−2-−1 °C (lit.)
蒸气压
0.0±0.3 mmHg at 25°C
闪点
华氏:235.4 °F 摄氏:113 °C
密度
1.013 g/mL at 25 °C(lit.)
计算特性
精确分子量
156.09400
氢键供体数量
0
氢键受体数量
0
可旋转化学键数量
0
同位素质量
156.0939
重原子数量
12
复杂度
150
同位素原子数量
0
确定原子立构中心数量
0
不确定原子立构中心数量
0
确定化学键立构中心数量
0
不确定化学键立构中心数量
0
共价键单元数量
1
疏水参数计算参考值(XlogP)
4.3
互变异构体数量
无
表面电荷
0
拓扑分子极性表面积
0
相关文献
1.
Separation performance of a large π-conjugated truxene-based dendrimer as stationary phase for gas chromatography
Meng Wang,Yinhui Yang,Meiling Qi,Jinliang Wang RSC Adv. 2017 7 44665
2.
Nitration of dimethylnaphthalenes in acetic anhydride
Alun Davies,Keith D. Warren J. Chem. Soc. B 1969 873
3.
Notes
S. S. Joshi,G. D. Tuli,T. C. H. Hill,J. F. Sumner,H. J. Emeléus,F. G. A. Stone,T. H. Bevan,G. I. Gregory,T. Malkin,A. G. Poole,E. E. Turner,George A. R. Kon,Wesley Cocker,Donal H. Hayes,D. Magrath,V. Petrow,R. Royer,Isaac Goodman,J. K. Norymberski J. Chem. Soc. 1951 837
4.
Capture and identification of coke precursors to elucidate the deactivation route of the methanol-to-olefin process over H-SAPO-34
Bowen Yu,Wenna Zhang,Yingxu Wei,Xinqiang Wu,Tantan Sun,Benhan Fan,Shutao Xu,Zhongmin Liu Chem. Commun. 2020 56 8063
5.
Formation of a 1,3-dipolar nitro addition product from the photochemical reaction of 1,2-dimethylnaphthalene and tetranitromethane
Craig P. Butts,Jane L. Calvert,Lennart Eberson,Michael P. Hartshorn,Ward T. Robinson J. Chem. Soc. Chem. Commun. 1993 1513
6.
624. Hydrogen transfer. Part XII. Dehydrogenation of “blocked” hydroaromatic compounds by quinones
E. A. Braude,L. M. Jackman,R. P. Linstead,G. Lowe J. Chem. Soc. 1960 3123
7.
The critical role of additives in binary halogen-free solvent systems for the general processing of highly efficient organic solar cells
Kai Yao,Yun-Xiang Xu,Xiaofeng Wang,Fan Li,Jiren Yuan RSC Adv. 2015 5 93689
8.
Tetraphenylethylene-functionalized hexaphenylbenzene with unique conformation-driven selectivity for gas chromatographic separations
Yinhui Yang,Meiling Qi,Jinliang Wang New J. Chem. 2020 44 2890
9.
Gas-phase thermochemistry of polycyclic aromatic hydrocarbons: an approach integrating the quantum chemistry composite scheme and reaction generator
Irina Minenkova,Arseniy A. Otlyotov,Luigi Cavallo,Yury Minenkov Phys. Chem. Chem. Phys. 2022 24 3163
10.
Non-halogenated diphenyl-chalcogenide solvent processing additives for high-performance polymer bulk-heterojunction solar cells
Song Yi Park,Seyeong Song,Yung Jin Yoon,Tack Ho Lee,Na Gyeong An,Bright Walker,Jin Young Kim RSC Adv. 2018 8 39777
参考资料
Reaxys RN
2039376
Beilstein
5(4)1708
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