915919-86-7 Purity
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Specification
The molecular formula of Chembrdg-bb 4011062 is C10H12O2S.
The molecular weight of Chembrdg-bb 4011062 is 196.27 g/mol.
The IUPAC name of Chembrdg-bb 4011062 is 2,2-dimethyl-1-thiophen-2-ylcyclopropane-1-carboxylic acid.
The InChI code of Chembrdg-bb 4011062 is InChI=1S/C10H12O2S/c1-9(2)6-10(9,8(11)12)7-4-3-5-13-7/h3-5H,6H2,1-2H3,(H,11,12).
The InChIKey of Chembrdg-bb 4011062 is PYCZYXYIEAWQSJ-UHFFFAOYSA-N.
The canonical SMILES of Chembrdg-bb 4011062 is CC1(CC1(C2=CC=CS2)C(=O)O).
The CAS number of Chembrdg-bb 4011062 is 915919-98-1.
The XLogP3-AA value of Chembrdg-bb 4011062 is 2.3.
Chembrdg-bb 4011062 has 1 hydrogen bond donor count.
Chembrdg-bb 4011062 has 3 hydrogen bond acceptor counts.