| CAS Number | 2657-44-5 |
| Catalog Number | AG002TQM(AGN-PC-0JO7BV) |
| Chemical Name | 2-Naphthalenebutanol |
| IUPAC Name | 4-naphthalen-2-ylbutan-1-ol |
| InChI | InChI=1S/C14H16O/c15-10-4-3-5-12-8-9-13-6-1-2-7-14(13)11-12/h1-2,6-9,11,15H,3-5,10H2 |
| InChI Key | HCFPOCQNXGQTIC-UHFFFAOYSA-N |
| MDL Number | MFCD30741485 |
| Molecular Formula | C14H16O |
| Molecular Weight | 200.2762 |
| NSC Number | 21045 |
| SMILES | OCCCCc1ccc2c(c1)cccc2 |
| Synonyms | 2-Naphthalenebutanol,
2657-44-5,
4-naphthalen-2-ylbutan-1-ol,
NSC21045,
AC1L5G3S,
AC1Q7CP4,
4-(2-Naphthyl)-1-butanol,
SCHEMBL130490,
CTK1A4330,
4-(naphthalen-2-yl)butan-1-ol,
DTXSID60281272,
MFCD30741485,
NSC-21045,
AKOS030228039,
KS-0000005L,
CS-0058304,
AR-1E4246,
CID228275,
3204-73-7,
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| Complexity | 178 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 200.12g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 200.281g/mol |
| Monoisotopic Mass | 200.12g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 20.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.9 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number