Cas no 312517-86-5 (4-{(2-Furylmethyl)thiomethyl}benzoic acid)
312517-86-5 structure
Product Name:4-{(2-Furylmethyl)thiomethyl}benzoic acid
CAS No:312517-86-5
MF:C13H12O3S
MW:248.297582626343
MDL:MFCD01418359
CID:321891
PubChem ID:690681
Update Time:2025-04-19
4-{(2-Furylmethyl)thiomethyl}benzoic acid Chemical and Physical Properties
Names and Identifiers
-
- Benzoic acid,4-[[(2-furanylmethyl)thio]methyl]-
- 4-(furan-2-ylmethylsulfanylmethyl)benzoic acid
- 4-(Furan-2-ylmethylsulfanylmethyl)-benzoic acid
- 4-[(2-furylmethylthio)methyl]benzoic acid
- SB61335
- SR-01000523635-1
- HMS2176K21
- 312517-86-5
- 4-{[(2-furylmethyl)thio]methyl}benzoic acid
- CHEMBL1548444
- DTXSID10351095
- 4-([(2-Furylmethyl)thio]methyl)benzoic acid
- SMR000109199
- Cambridge id 7058412
- MLS000113296
- LS-07156
- 4-({[(furan-2-yl)methyl]sulfanyl}methyl)benzoic acid
- AKOS000103034
- CS-0314127
- 4-(((Furan-2-ylmethyl)thio)methyl)benzoic acid
- MFCD01418359
- 4-(((Furan-2-ylmethyl)thio)methyl)benzoicacid
- SR-01000523635
- STK164622
- benzoic acid, 4-[[(2-furanylmethyl)thio]methyl]-
- ALBB-023033
- 4-{[(furan-2-ylmethyl)sulfanyl]methyl}benzoic acid
- 4-{(2-Furylmethyl)thiomethyl}benzoic acid
-
- MDL： MFCD01418359
- Inchi： 1S/C13H12O3S/c14-13(15)11-5-3-10(4-6-11)8-17-9-12-2-1-7-16-12/h1-7H,8-9H2,(H,14,15)
- InChI Key： YKWFODPJEKPJPA-UHFFFAOYSA-N
- SMILES： S(CC1=CC=CO1)CC1C=CC(C(=O)O)=CC=1
Computed Properties
- Exact Mass: 248.05100
- Monoisotopic Mass: 247.04289
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 17
- Rotatable Bond Count: 5
- Complexity: 244
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 78.6
- XLogP3: 2.5
Experimental Properties
- Boiling Point: 408.5°Cat760mmHg
- Flash Point: 200.8°C
- PSA: 75.74000
- LogP: 3.41120
4-{(2-Furylmethyl)thiomethyl}benzoic acid Security Information
-
Hazardous Material Identification：
- HazardClass：IRRITANT
4-{(2-Furylmethyl)thiomethyl}benzoic acid Customs Data
- HS CODE：2932190090
- Customs Data：
China Customs Code:
2932190090Overview:
2932190090 Other structurally non fused furan ring compounds. VAT:17.0% Tax refund rate:9.0% Regulatory conditions:nothing MFN tariff:6.5% general tariff:20.0%
Declaration elements:
Product Name, component content, use to
Summary:
2932190090 other compounds containing an unfused furan ring (whether or not hydrogenated) in the structure VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:20.0%
4-{(2-Furylmethyl)thiomethyl}benzoic acid Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| SHANG HAI XIAN DING Biotechnology Co., Ltd. | 010544-500mg |
4-(Furan-2-ylmethylsulfanylmethyl)-benzoic acid |
312517-86-5 | 500mg |
3251CNY | 2021-05-07 | ||
| TRC | F254430-250mg |
4-{[(2-Furylmethyl)thio]methyl}benzoic acid |
312517-86-5 | 250mg |
$ 275.00 | 2022-06-05 | ||
| TRC | F254430-500mg |
4-{[(2-Furylmethyl)thio]methyl}benzoic acid |
312517-86-5 | 500mg |
$ 450.00 | 2022-06-05 | ||
| TRC | F254430-1000mg |
4-{[(2-Furylmethyl)thio]methyl}benzoic acid |
312517-86-5 | 1g |
$ 720.00 | 2022-06-05 | ||
| Matrix Scientific | 010544-500mg |
4-(Furan-2-ylmethylsulfanylmethyl)-benzoic acid |
312517-86-5 | 500mg |
$200.00 | 2023-09-11 | ||
| Matrix Scientific | 010544-1g |
4-(Furan-2-ylmethylsulfanylmethyl)-benzoic acid |
312517-86-5 | 1g |
$308.00 | 2023-09-11 | ||
| abcr | AB413898-500 mg |
4-{[(2-Furylmethyl)thio]methyl}benzoic acid |
312517-86-5 | 500MG |
€254.60 | 2023-02-19 | ||
| abcr | AB413898-1 g |
4-{[(2-Furylmethyl)thio]methyl}benzoic acid |
312517-86-5 | 1 g |
€322.50 | 2023-07-19 | ||
| Fluorochem | 057847-1g |
4-(Furan-2-ylmethylsulfanylmethyl)-benzoic acid |
312517-86-5 | 1g |
￡307.00 | 2022-03-01 | ||
| SHANG HAI XIAN DING Biotechnology Co., Ltd. | 010544-500mg |
4-(Furan-2-ylmethylsulfanylmethyl)-benzoic acid |
312517-86-5 | 500mg |
3251.0CNY | 2021-07-05 |
4-{(2-Furylmethyl)thiomethyl}benzoic acid Related Literature
-
Xinhuan Wang,Shuangfei Cai,Cui Qi Analyst, 2017,142, 2500-2506
-
Qiyuan Wu,Shangmin Xiong,Peichuan Shen,Shen Zhao,Alexander Orlov Catal. Sci. Technol., 2015,5, 2059-2064
-
Max Attwood,Hiroki Akutsu,Lee Martin,Toby J. Blundell,Pierre Le Maguere,Scott S. Turner Dalton Trans., 2021,50, 11843-11851
-
Peiyuan Zeng,Xiaoxiao Wang,Ming Ye,Qiuyang Ma,Jianwen Li,Wanwan Wang,Baoyou Geng,Zhen Fang RSC Adv., 2016,6, 23074-23084
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