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Product details

名称

3,5-二甲氧基-4-甲基苯甲酸

英文别名

英文名称

3，5-Dimethoxy-4-methylbenzoic acid

货号

D136423-1g

包装规格

浓度

≥97%

运输条件

常规运输

产品介绍

Product Application: 3,5-Dimethoxy-4-methylbenzoic acid undergoes reduction in the presence of sodium in ethanol to prepare 1,4-dihydro-3,5-dimethoxy- kmethylbenzoic acid.

CAS号

61040-81-1

分子式

C10H12O4

分子量

196.2 g/mol

Beilstein号

2695238

MDL号

MFCD00017506

PubChem编号

3764486

Isomeric SMILES

CC1=C(C=C(C=C1OC)C(=O)O)OC

IIUPAC Name

3,5-dimethoxy-4-methylbenzoic acid

INCHI

1S/C10H12O4/c1-6-8(13-2)4-7(10(11)12)5-9(6)14-3/h4-5H,1-3H3,(H,11,12)

InChi Key

QIBMVRYNEXOCCF-UHFFFAOYSA-N

Smiles

CC1=C(C=C(C=C1OC)C(=O)O)OC

PubChem SID

488194553

溶解性

Soluble in liquid ammonia.

熔点

210-216°C

氢键供体数Hydrogen Bond Donor Count

氢键受体数Hydrogen Bond Acceptor Count

可旋转键计数Rotatable Bond Count

精确质量Exact Mass

196.074 Da

单同位素质量Monoisotopic Mass

196.074 Da

拓扑极表面积Topological Polar Surface Area

55.800 Å²

重原子数Heavy Atom Count

形式电荷Formal Charge

复杂度Complexity

190

同位素原子数Isotope Atom Count

共价键合单元计数Covalently-Bonded Unit Count

XLogP3

1.8

Reaxy-Rn

2695238

Safety

「No Dangerous Attributes」

「No upstream and downstream information yet」

Technical Documents

「No technical documents」

Articles

「No related articles yet」

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