| CAS Number | 1923268-95-4 |
| Catalog Number | AG00J2UI |
| Chemical Name | [(2R)-2-aminobutyl]dimethylamine dihydrochloride |
| IUPAC Name | (2R)-1-N,1-N-dimethylbutane-1,2-diamine |
| InChI | InChI=1S/C6H16N2/c1-4-6(7)5-8(2)3/h6H,4-5,7H2,1-3H3/t6-/m1/s1 |
| InChI Key | AKRUIVSMWDCKNI-ZCFIWIBFSA-N |
| MDL Number | MFCD28893267 |
| Molecular Formula | C6H18Cl2N2 |
| Molecular Weight | 189.1265 |
| SMILES | Cl.Cl.CC[C@H](CN(C)C)N |
| Synonyms | [(2R)-2-Aminobutyl]dimethylamine dihydrochloride,
AC1OE4CK,
1923268-95-4,
SCHEMBL360065,
[(2R)-2-aminobutyl]dimethylamine,
ZINC19368458,
AJ-72989,
(2R)-1-N,1-N-dimethylbutane-1,2-diamine,
CID6998885,
BRN 2069349,
(2r)-n1,n1-dimethyl-1,2-butanediamine,
796038-11-4,
|
| Complexity | 52.5 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 116.131g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 8 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 116.208g/mol |
| Monoisotopic Mass | 116.131g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 29.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.3 |
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Certificate of Analysis
Lot Number