5-Chloroacetamido-2-methylene-1,3,3-trimethylindoline - CAS 51980-53-1
Catalog: |
BB070215 |
Product Name: |
5-Chloroacetamido-2-methylene-1,3,3-trimethylindoline |
CAS: |
51980-53-1 |
Synonyms: |
2-Chloro-N-(2,3-dihydro-1,3,3-trimethyl-2-methylene-1H-indol-5-yl)acetamide |
IUPAC Name: | 2-chloro-N-(1,3,3-trimethyl-2-methylideneindol-5-yl)acetamide |
Description: | 5-Chloroacetamido-2-methylene-1,3,3-trimethylindoline (cas# 51980-53-1) is a compound useful in organic synthesis. |
Molecular Weight: | 264.75 |
Molecular Formula: | C14H17ClN2O |
Canonical SMILES: | CC1(C(=C)N(C2=C1C=C(C=C2)NC(=O)CCl)C)C |
InChI: | InChI=1S/C14H17ClN2O/c1-9-14(2,3)11-7-10(16-13(18)8-15)5-6-12(11)17(9)4/h5-7H,1,8H2,2-4H3,(H,16,18) |
InChI Key: | LQAYFOAWQOGESO-UHFFFAOYSA-N |
Melting Point: | 108-114°C (dec.) |
Solubility: | DMF, DMSO, Ethanol, Methanol |
Appearance: | Purple Solid |
Storage: | Refrigerator, Under Inert Atmosphere |
Complexity: | 367 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 264.1029409 |
Formal Charge: | 0 |
Heavy Atom Count: | 18 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 264.1029409 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 32.3Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.2 |
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