| CAS Number | 102450-00-0 |
| Catalog Number | AG0007IO(AGN-PC-09OFRK) |
| Chemical Name | 2-Methylcyclohexaneethanamine |
| IUPAC Name | 2-(2-methylcyclohexyl)ethanamine |
| InChI | InChI=1S/C9H19N/c1-8-4-2-3-5-9(8)6-7-10/h8-9H,2-7,10H2,1H3 |
| InChI Key | BXKLFCREVJPUJY-UHFFFAOYSA-N |
| MDL Number | MFCD07772984 |
| Molecular Formula | C9H19N |
| Molecular Weight | 141.2539 |
| SMILES | CC1C(CCN)CCCC1 |
| Synonyms | 102450-00-0,
2-(2-methylcyclohexyl)ethan-1-amine,
2-(2-METHYLCYCLOHEXYL)ETHANAMINE,
Cyclohexaneethanamine,2-methyl-,
ACMC-1CB0X,
SCHEMBL1755688,
CTK4A1108,
Cyclohexaneethanamine, 2-methyl-,
DTXSID00692904,
AKOS010970140,
NE40749,
2-(2-METHYL-CYCLOHEXYL)-ETHYLAMINE,
EN300-77468,
K(BIOTIN)-RFARKGSLRQKNV,
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| Complexity | 90.7 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 141.152g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 141.258g/mol |
| Monoisotopic Mass | 141.152g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 26A^2 |
| Undefined Atom Stereocenter Count | 2 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.6 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number