| CAS Number | 850033-74-8 |
| Catalog Number | AG00G68N(AGN-PC-0UWG67) |
| Chemical Name | R-2-N-CBZ-propane-1,2-diaMine-HCl |
| IUPAC Name | benzyl N-[(2R)-1-aminopropan-2-yl]carbamate;hydrochloride |
| InChI | InChI=1S/C11H16N2O2.ClH/c1-9(7-12)13-11(14)15-8-10-5-3-2-4-6-10;/h2-6,9H,7-8,12H2,1H3,(H,13,14);1H/t9-;/m1./s1 |
| InChI Key | XTQGLCRZNBCNJH-SBSPUUFOSA-N |
| MDL Number | MFCD16295170 |
| Molecular Formula | C11H17ClN2O2 |
| Molecular Weight | 244.7179 |
| SMILES | Cl.NC[C@@H](C)NC(OCC1=CC=CC=C1)=O |
| Synonyms | R-2-N-CBZ-propane-1,2-diamine-HCl,
850033-74-8,
(R)-Benzyl (1-aminopropan-2-yl)carbamate hydrochloride,
r-2-n-cbz-propane-1,2-diamine hydrochloride,
SCHEMBL3557210,
DTXSID70704265,
MFCD16295170,
AKOS015923430,
AB0000150,
S-1312,
Benzyl [(2R)-1-aminopropan-2-yl]carbamate--hydrogen chloride (1/1),
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| Complexity | 191 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 244.098g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 244.719g/mol |
| Monoisotopic Mass | 244.098g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 64.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number