4-Chloro-2-methyl-n-(pyrrolidin-2-ylmethyl)aniline Dioxalate - CAS 1177353-27-3
Catalog: |
BB055536 |
Product Name: |
4-Chloro-2-methyl-n-(pyrrolidin-2-ylmethyl)aniline Dioxalate |
CAS: |
1177353-27-3 |
Synonyms: |
4-chloro-2-methyl-N-(pyrrolidin-2-ylmethyl)aniline dioxalate; 4-chloro-2-methyl-N-(pyrrolidin-2-ylmethyl)aniline; oxalic acid; 4-chloro-2-methyl-N-(pyrrolidin-2-ylmethyl)anilinedioxalate |
IUPAC Name: | 4-chloro-2-methyl-N-(pyrrolidin-2-ylmethyl)anilineoxalic acid |
Description: | 4-Chloro-2-methyl-n-(pyrrolidin-2-ylmethyl)aniline dioxalate |
Molecular Weight: | 224.73 +(180.06) |
Molecular Formula: | C12H17ClN2+C4H4O8 |
Canonical SMILES: | CC1=C(C=CC(=C1)Cl)NCC2CCCN2.C(=O)(C(=O)O)O.C(=O)(C(=O)O)O |
InChI: | InChI=1S/C12H17ClN2.2C2H2O4/c1-9-7-10(13)4-5-12(9)15-8-11-3-2-6-14-112*3-1(4)2(5)6/h4-5,7,11,14-15H,2-3,6,8H2,1H32*(H,3,4)(H,5,6) |
InChI Key: | MRCARCPKLSWUMU-UHFFFAOYSA-N |
Complexity: | 270 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 3 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 404.0986433 |
Formal Charge: | 0 |
Heavy Atom Count: | 27 |
Hydrogen Bond Acceptor Count: | 10 |
Hydrogen Bond Donor Count: | 6 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 404.0986433 |
Rotatable Bond Count: | 5 |
Topological Polar Surface Area: | 173Ų |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
-
Catalog: BB069173
((1-Chloro-2-methylpropan-2-yl)oxy)trimethylsilane
Detail
-
Catalog: BB067784
((1R,2R)-2-(2,3-Dihydrobenzofuran-4-yl)cyclopropyl)methanamine
Detail
-
Catalog: BB069926
((2R,4R)-2-(Chloromethyl)-2-(2,4-dichlorophenyl)-1,3-dioxolan-4-yl)methyl 4-Methylbenzenesulfonate
Detail
-
Catalog: BB056966
(((3aS,5aR,8aR,8bS)-2,2,7,7-Tetramethyltetrahydro-3aH-bis([1,3]dioxolo)[4,5-b:4',5'-d]pyran-3a-yl)methyl)-L-arginine
Detail
-
Catalog: BB069928
((2S,4R)-2-(Chloromethyl)-2-(2,4-dichlorophenyl)-1,3-dioxolan-4-yl)methyl 4-Methylbenzenesulfonate
Detail
-
Catalog: BB072640
((2R,3S,4R,5R)-5-(4-(Benzyloxy)-2-oxopyridin-1(2H)-yl)-3,4-dihydroxytetrahydrofuran-2-yl)methyl bis(2-cyanoethyl) Phosphate
Detail
-
Catalog: BB074488
((1R,3R)-3-Amino-cyclopentyl)-carbamic Acid tert-Butyl Ester
Detail
-
Catalog: BB069924
((2S,4S)-2-(Chloromethyl)-2-(2,4-dichlorophenyl)-1,3-dioxolan-4-yl)methyl 4-Methylbenzenesulfonate
Detail
Online Inquiry
Customer Support
Customer Centered
Related Functional Groups
Other Building Blocks
Customers Also Viewed
INDUSTRY LEADERS TRUST OUR PRODUCTS