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名称
3,5-二氯苯甲醇
别名
3,5-二氯苄醇
英文别名
(3,5-Dichlorophenyl)methanol # | 3,5-DICHLOROBENZENEMETHANOL | D3791 | InChI=1/C7H6Cl2O/c8-6-1-5(4-10)2-7(9)3-6/h1-3,10H,4H2 | Bionet2_000905 | AC-26186 | SCHEMBL92904 | HMS1366J03 | VSNNLLQKDRCKCB-UHFFFAOYSA- | A8415 | 3,5-Dichlorobenzyl alcohol, 98% | 1
英文名称
3,5-Dichlorobenzyl alcohol
货号
D139056-10g
包装规格
10g
浓度
≥98%(GC)
运输条件
常规运输
产品介绍
It was used in the preparation of 3,5-dichlorophenylacetonitrile via reaction with boiling SOCl2, followed by reaction with NaCN. It was also used in the synthesis of tert-butyl 2-cyano-3-(3,5-dichlorophenyl)-propanoate via Iridium-catalysed alkylation of tert-butyl cyanoacetate. It was used in the preparation of 3,5-dichlorophenylacetonitrile via reaction with boiling SOCl2, followed by reaction with NaCN. It was also used in the synthesis of tert-butyl 2-cyano-3-(3,5-dichlorophenyl)-propanoate via Iridium-catalysed alkylation of tert-butyl cyanoacetate.
应用
It was used in the preparation of 3,5-dichlorophenylacetonitrile via reaction with boiling SOCl2, followed by reaction with NaCN. It was also used in the synthesis of tert-butyl 2-cyano-3-(3,5-dichlorophenyl)-propanoate via Iridium-catalysed alkylation of tert-butyl cyanoacetate.
CAS号
60211-57-6
分子式
Cl2C6H3CH2OH
分子量
177.03 g/mol
Beilstein号
6(3)1558
EC号
262-109-1
MDL号
MFCD00004634
PubChem编号
43236
Isomeric SMILES
C1=C(C=C(C=C1Cl)Cl)CO
IIUPAC Name
(3,5-dichlorophenyl)methanol
INCHI
1S/C7H6Cl2O/c8-6-1-5(4-10)2-7(9)3-6/h1-3,10H,4H2
InChi Key
VSNNLLQKDRCKCB-UHFFFAOYSA-N
Smiles
C1=C(C=C(C=C1Cl)Cl)CO
PubChem SID
504753625
溶解性
可溶于甲醇
熔点
79 °C
氢键供体数Hydrogen Bond Donor Count
1
氢键受体数Hydrogen Bond Acceptor Count
1
可旋转键计数Rotatable Bond Count
1
精确质量Exact Mass
175.98 Da
单同位素质量Monoisotopic Mass
175.98 Da
拓扑极表面积Topological Polar Surface Area
20.200 Ų
重原子数Heavy Atom Count
10
形式电荷Formal Charge
0
复杂度Complexity
97.800
同位素原子数Isotope Atom Count
0
共价键合单元计数Covalently-Bonded Unit Count
1
XLogP3
2.300
Reaxy-Rn
1936389
Safety
「No Dangerous Attributes」
Related
「No upstream and downstream information yet」
Technical Documents
「No technical documents」
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Research chemical 10g; ≥98%; GC

Research chemical 10g; ≥98%; GC; supplied for laboratory research, analysis, inspection, and scientific procurement use; specifications: 10g; ≥98%; GC.

item number:D139056-10g
Product model:10g
level: 10g; ≥98%; GC
Lead Time:30days
sold 627 Items
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Specifications:

10g

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