| CAS Number | 62653-78-5 |
| Catalog Number | AG00IB27(AGN-PC-0ODT95) |
| Chemical Name | H-D-Val-D-val-OH |
| IUPAC Name | (2R)-2-[[(2R)-2-amino-3-methylbutanoyl]amino]-3-methylbutanoic acid |
| InChI | InChI=1S/C10H20N2O3/c1-5(2)7(11)9(13)12-8(6(3)4)10(14)15/h5-8H,11H2,1-4H3,(H,12,13)(H,14,15)/t7-,8-/m1/s1 |
| InChI Key | KRNYOVHEKOBTEF-HTQZYQBOSA-N |
| MDL Number | MFCD00237311 |
| Molecular Formula | C10H20N2O3 |
| Molecular Weight | 216.2774 |
| SMILES | CC(C)[C@@H](N)C(=O)N[C@H](C(C)C)C(=O)O |
| Synonyms | H-D-Val-D-val-OH,
D-VAL-D-VAL-OH,
62653-78-5,
D-Valine, N-D-valyl-,
(R)-2-((R)-2-Amino-3-methylbutanamido)-3-methylbutanoic acid,
AC1O531D,
CTK2B5047,
DTXSID40423794,
ZINC1848352,
KM5662,
MFCD00237311,
AKOS017541002,
(2R)-2-[[(2R)-2-amino-3-methylbutanoyl]amino]-3-methylbutanoic acid,
Valylvaline,
Val-val,
CID6427011,
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| Complexity | 239 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 2 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 216.147g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 216.281g/mol |
| Monoisotopic Mass | 216.147g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 92.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -2.8 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number