| CAS Number | 56684-95-8 |
| Catalog Number | AG00F05V(AGN-PC-0SM5M5) |
| Chemical Name | 2-[(1-hydroxypropan-2-yl)(methyl)amino]propan-1-ol |
| EC Number | 260-338-1 |
| IUPAC Name | 2-[1-hydroxypropan-2-yl(methyl)amino]propan-1-ol |
| InChI | InChI=1S/C7H17NO2/c1-6(4-9)8(3)7(2)5-10/h6-7,9-10H,4-5H2,1-3H3 |
| InChI Key | AOEMTQGYLIGXQM-UHFFFAOYSA-N |
| MDL Number | MFCD32206192 |
| Molecular Formula | C7H17NO2 |
| Molecular Weight | 147.2154 |
| SMILES | CN(C(C)CO)C(C)CO |
| Synonyms | 2,2'-(Methylimino)dipropanol,
56684-95-8,
EINECS 260-338-1,
2-[1-hydroxypropan-2-yl(methyl)amino]propan-1-ol,
AC1L3O91,
SCHEMBL2509780,
CTK5A5566,
1-Propanol,2,2'-(methylimino)bis-,
2,2'-(Methylimino)bis(1-propanol),
C7-H17-N-O2,
CID92498,
1-Propanol, 2,2'-(methylimino)bis-,
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| Complexity | 77.7 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 147.126g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 147.218g/mol |
| Monoisotopic Mass | 147.126g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 43.7A^2 |
| Undefined Atom Stereocenter Count | 2 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.2 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number