| CAS Number | 1104193-66-9 |
| Catalog Number | AG017AEP(AGN-PC-0WO4T4) |
| Chemical Name | (Cyclopropylmethyl)(2,2-dimethoxyethyl)amine |
| IUPAC Name | N-(cyclopropylmethyl)-2,2-dimethoxyethanamine |
| InChI | InChI=1S/C8H17NO2/c1-10-8(11-2)6-9-5-7-3-4-7/h7-9H,3-6H2,1-2H3 |
| InChI Key | NHGWIPBDFWJQFG-UHFFFAOYSA-N |
| MDL Number | MFCD12157749 |
| Molecular Formula | C8H17NO2 |
| Molecular Weight | 159.2261 |
| SMILES | COC(OC)CNCC1CC1 |
| Synonyms | (cyclopropylmethyl)(2,2-dimethoxyethyl)amine,
1104193-66-9,
AC1Q44GI,
SCHEMBL2281448,
CTK6J3367,
NHGWIPBDFWJQFG-UHFFFAOYSA-N,
ZINC37473107,
AKOS010034306,
MCULE-6022235180,
NE22544,
Cyclopropylmethyl-(2,2-dimethoxy-ethyl)-amine,
EN300-55800,
N-(cyclopropylmethyl)-(2,2-dimethoxyethanamine),
F2158-1941,
Z857667900,
N-(cyclopropylmethyl)-2,2-dimethoxyethan-1-amine,
|
| Complexity | 100 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 159.126g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 159.229g/mol |
| Monoisotopic Mass | 159.126g/mol |
| Rotatable Bond Count | 6 |
| Topological Polar Surface Area | 30.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number