| CAS Number | 53774-63-3 |
| Catalog Number | AG00DAXP(AGN-PC-0OBYN1) |
| Chemical Name | N-(5-AMINO-5-CARBOXYPENTYL)-ACETAMIDINE |
| IUPAC Name | 2-amino-6-(1-aminoethylideneamino)hexanoic acid |
| InChI | InChI=1S/C8H17N3O2/c1-6(9)11-5-3-2-4-7(10)8(12)13/h7H,2-5,10H2,1H3,(H2,9,11)(H,12,13) |
| InChI Key | ONYFNWIHJBLQKE-UHFFFAOYSA-N |
| MDL Number | MFCD00792818 |
| Molecular Formula | C8H17N3O2 |
| Molecular Weight | 187.2395 |
| SMILES | O=C(O)C(N)CCCCNC(C)=N |
| Synonyms | N-(5-amino-5-carboxypentyl)acetamidine,
2-AMINO-6-ETHANIMIDAMIDOHEXANOIC ACID,
53774-63-3,
6-Acetimidamido-2-aminohexanoic acid,
N6-(1-IMINOETHYL)-L-LYSINE,
AC1L1GVT,
SCHEMBL934874,
ONYFNWIHJBLQKE-UHFFFAOYSA-N,
HSCI1_000308,
2-Amino-6-[(1-iminoethyl)amino]hexanoic acid,
2-amino-6-(1-aminoethylideneamino)hexanoic acid,
L-NIL,
CID3863,
L-Lysine, N6-(1-iminoethyl)-,
NCGC00015566-01,
|
| Complexity | 192 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 187.132g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 187.243g/mol |
| Monoisotopic Mass | 187.132g/mol |
| Rotatable Bond Count | 6 |
| Topological Polar Surface Area | 102A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -3.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number