Cas no 54494-61-0 (3-Thiophenecarboxylicacid, 2-chloro-5-methyl-)
54494-61-0 structure
Product Name:3-Thiophenecarboxylicacid, 2-chloro-5-methyl-
CAS No:54494-61-0
MF:C6H5ClO2S
MW:176.620699644089
CID:366459
PubChem ID:18938030
Update Time:2025-04-19
3-Thiophenecarboxylicacid, 2-chloro-5-methyl- Chemical and Physical Properties
Names and Identifiers
-
- 3-Thiophenecarboxylicacid, 2-chloro-5-methyl-
- 2-chloro-5-methyl-3-Thiophenecarboxylic acid
- 2-CHLORO-5-METHYLTHIOPHENE-3-CARBOXYLIC ACID
- 2-Chlor-5-methyl-3-thiophencarbonsaeure
- 2-chloro-5-methyl-thiophene-3-carboxylic acid
- QC-6004
- SCHEMBL8629968
- FT-0655129
- A830213
- DTXSID30596663
- 54494-61-0
- MUQQZXLAGBQFRY-UHFFFAOYSA-N
- AKOS006277202
-
- Inchi： 1S/C6H5ClO2S/c1-3-2-4(6(8)9)5(7)10-3/h2H,1H3,(H,8,9)
- InChI Key： MUQQZXLAGBQFRY-UHFFFAOYSA-N
- SMILES： ClC1=C(C(=O)O)C=C(C)S1
Computed Properties
- Exact Mass: 175.97000
- Monoisotopic Mass: 175.9698783g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 10
- Rotatable Bond Count: 1
- Complexity: 151
- 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
- XLogP3: 2.5
- Topological Polar Surface Area: 65.5?2
Experimental Properties
- PSA: 65.54000
- LogP: 2.40810
3-Thiophenecarboxylicacid, 2-chloro-5-methyl- Customs Data
- HS CODE：2934999090
- Customs Data：
China Customs Code:
2934999090Overview:
2934999090. Other heterocyclic compounds. VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:6.5%. general tariff:20.0%
Declaration elements:
Product Name, component content, use to
Summary:
2934999090. other heterocyclic compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%
3-Thiophenecarboxylicacid, 2-chloro-5-methyl- Related Literature
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Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
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J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
-
Gang Pan,Yi-jie Bao,Jie Xu,Tao Liu,Cheng Liu,Yan-yan Qiu,Xiao-jing Shi,Hui Yu,Ting-ting Jia,Xia Yuan,Ze-ting Yuan,Yi-jun Cao RSC Adv., 2016,6, 42109-42119
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Huading Zhang,Lee R. Moore,Maciej Zborowski,P. Stephen Williams,Shlomo Margel,Jeffrey J. Chalmers Analyst, 2005,130, 514-527
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Xiaoming Liu,Zachary D. Hood,Wangda Li,Donovan N. Leonard,Arumugam Manthiram,Miaofang Chi J. Mater. Chem. A, 2021,9, 2111-2119
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