(3AR,6aR)-5-Methylhexahydropyrrolo[3,4-b]pyrrole-1-carboxylic Acid Tert-butyl Ester - CAS 948846-60-4
Catalog: |
BB059631 |
Product Name: |
(3AR,6aR)-5-Methylhexahydropyrrolo[3,4-b]pyrrole-1-carboxylic Acid Tert-butyl Ester |
CAS: |
948846-60-4 |
Synonyms: |
(3aR,6aR)-Hexahydro-5-methyl-pyrrolo[3,4-b]pyrrole-1(2H)-carboxylic Acid Tert-butyl Ester; (3aR,6aR)-Hexahydro-5-methyl-pyrrolo[3,4-b]pyrrole-1(2H)-carboxylic Acid 1,1-Dimethylethyl Ester |
IUPAC Name: | tert-butyl (3aR,6aR)-5-methyl-2,3,3a,4,6,6a-hexahydropyrrolo[2,3-c]pyrrole-1-carboxylate |
Description: | (3AR,6aR)-5-Methylhexahydropyrrolo[3,4-b]pyrrole-1-carboxylic Acid Tert-butyl Ester is used as a reactant in the synthesis of histamine H3 receptor antagonist. |
Molecular Weight: | 226.32 |
Molecular Formula: | C12H22N2O2 |
Canonical SMILES: | CC(C)(C)OC(=O)N1CCC2C1CN(C2)C |
InChI: | InChI=1S/C12H22N2O2/c1-12(2,3)16-11(15)14-6-5-9-7-13(4)8-10(9)14/h9-10H,5-8H2,1-4H3/t9-,10+/m1/s1 |
InChI Key: | QAVYARXXRYFCCS-ZJUUUORDSA-N |
References: | Zhao, C., et al. J. Med. Chem., 52, 4640 (2009). |
Complexity: | 285 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 2 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 226.168127949 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 226.168127949 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 32.8Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.4 |
-
Catalog: BB014781
1,4-Benzodioxane-6-carbonitrile
Detail
-
Catalog: BB012200
8-(tetramethyl-1,3,2-dioxaborolan-2-yl)-4H-chromen-4-one
Detail
-
Catalog: BB077194
(S)-(-)-1,2-epoxydecane
Detail
-
Catalog: BB016398
4-chloro-6-methylimidazo[2,1-f][1,2,4]triazine
Detail
-
Catalog: BB054600
3-glycidoxypropyltrimethoxysilane
Detail
-
Catalog: BB012925
6-(Dimethylamino)-2-naphthaldehyde
Detail
-
Catalog: BB016437
2-amino-3-{pyrrolo[2,1-f][1,2,4]triazin-5-yl}propanenitrile
Detail
-
Catalog: BB002009
Ethylenesulfate
Detail
Online Inquiry
Customer Support
Customer Centered
Related Functional Groups
Other Building Blocks
Customers Also Viewed
INDUSTRY LEADERS TRUST OUR PRODUCTS