| CAS Number | 919360-49-9 |
| Catalog Number | AG003E1M(AGN-PC-0CSWHI) |
| Chemical Name | 1-Boc-4-(4-hydroxy-2-butyl)piperidine |
| IUPAC Name | tert-butyl 4-(4-hydroxybutan-2-yl)piperidine-1-carboxylate |
| InChI | InChI=1S/C14H27NO3/c1-11(7-10-16)12-5-8-15(9-6-12)13(17)18-14(2,3)4/h11-12,16H,5-10H2,1-4H3 |
| InChI Key | ZEOVKUVEPGIQPI-UHFFFAOYSA-N |
| MDL Number | MFCD24543293 |
| Molecular Formula | C14H27NO3 |
| Molecular Weight | 257.3691 |
| SMILES | C(=O)(OC(C)(C)C)N1CCC(CC1)C(C)CCO |
| Synonyms | 1-Boc-4-(4-hydroxy-2-butyl)piperidine,
919360-49-9,
tert-butyl 4-(4-hydroxybutan-2-yl)piperidine-1-carboxylate,
SCHEMBL1576175,
ZEOVKUVEPGIQPI-UHFFFAOYSA-N,
5082AJ,
MFCD24543293,
AKOS023831434,
NE52939,
TRA0025747,
CS-11824,
SY030901,
CS-0079112,
FT-0760235,
KS-00000980,
MFCD24543293 (95%),
tert-Butyl 4-(3-hydroxy-1-methylpropyl)piperidine-1-carboxylate,
4-(3-Hydroxy-1-methylpropyl)piperidine-1-carboxylic acid tert-butyl ester,
C14H27NO3,
1008-19-1,
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| Complexity | 265 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 257.199g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 257.374g/mol |
| Monoisotopic Mass | 257.199g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 49.8A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.3 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number