4-Benzyl- 2-thiophenecarboxylic Acid - CAS 27921-49-9
Catalog: |
BB061712 |
Product Name: |
4-Benzyl- 2-thiophenecarboxylic Acid |
CAS: |
27921-49-9 |
Synonyms: |
4-benzylthiophene-2-carboxylic acid; 4-benzyl-2-thiophenecarboxylic acid; 4-Benzyl- 2-thiophenecarboxylic Acid |
IUPAC Name: | 4-benzylthiophene-2-carboxylic acid |
Molecular Weight: | 218.27 |
Molecular Formula: | C12H10O2S |
Canonical SMILES: | C1=CC=C(C=C1)CC2=CSC(=C2)C(=O)O |
InChI: | InChI=1S/C12H10O2S/c13-12(14)11-7-10(8-15-11)6-9-4-2-1-3-5-9/h1-5,7-8H,6H2,(H,13,14) |
InChI Key: | CVTUZGDJYOVVOT-UHFFFAOYSA-N |
Complexity: | 224 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 218.04015073 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 218.04015073 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 65.5Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.4 |
Online Inquiry
Customer Support
Customer Centered
Related Functional Groups
Other Building Blocks
-
[477552-93-5]
rac-Deshydroxy Formoterol
-
rac-Didemethyltimolol Maleate
-
(2R,5S,10aS,10bS)-10b-Hydroxy-5-isopropyl-2-methyl-3,6-dioxooctahydro-2H-oxazolo[3,2-a]pyrrolo[2,1-c]pyrazine-2-carboxylic Acid
-
[1456707-58-6]
(2R,6S)-2,6-Dimethyl-4-((R)-2-methyl-3-(4-(tert-pentyl)phenyl)propyl)morpholine-hydrochloride
-
[1456711-93-5]
(3-Phenoxyphenyl)methyl Ester 3-[(1Z)-2-chloro-3,3,3-trifluoro-1-propen-1-yl]-2,2-dimethyl-cyclopropanecarboxylic Acid
-
(6S)-2-Nitro-6-((tetrahydro-2H-pyran-2-yl)methoxy)-6,7-dihydro-5H-imidazo[2,1-b][1,3]oxazine
Customers Also Viewed
INDUSTRY LEADERS TRUST OUR PRODUCTS