| CAS Number | 115947-69-8 |
| Catalog Number | AG01AIC7(AGN-PC-0KOO11) |
| Chemical Name | 2,4-Dimethylpentane-1,2-diamine |
| IUPAC Name | 2,4-dimethylpentane-1,2-diamine |
| InChI | InChI=1S/C7H18N2/c1-6(2)4-7(3,9)5-8/h6H,4-5,8-9H2,1-3H3 |
| InChI Key | JIWVNNBIBQCVCD-UHFFFAOYSA-N |
| MDL Number | MFCD12190250 |
| Molecular Formula | C7H18N2 |
| Molecular Weight | 130.2312 |
| SMILES | CC(CC(CN)(N)C)C |
| Synonyms | 2,4-dimethylpentane-1,2-diamine,
115947-69-8,
AC1MI4PQ,
SCHEMBL5792114,
JIWVNNBIBQCVCD-UHFFFAOYSA-N,
AKOS009545164,
rac-2,4-dimethylpentane-1,2-diamine,
NE21398,
EN300-77371,
CID3062927,
|
| Complexity | 81 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 130.147g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 130.235g/mol |
| Monoisotopic Mass | 130.147g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 52A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number