| CAS Number | 1072946-31-6 |
| Catalog Number | AG003BWM(AGN-PC-07XTVZ) |
| Chemical Name | 4-Pentylcyclohex-1-enylboronic acid |
| IUPAC Name | (4-pentylcyclohexen-1-yl)boronic acid |
| InChI | InChI=1S/C11H21BO2/c1-2-3-4-5-10-6-8-11(9-7-10)12(13)14/h8,10,13-14H,2-7,9H2,1H3 |
| InChI Key | FNIVZIHUKLFDQI-UHFFFAOYSA-N |
| MDL Number | MFCD10699637 |
| Molecular Formula | C11H21BO2 |
| Molecular Weight | 196.0942 |
| SMILES | CCCCCC1CCC(=CC1)B(O)O |
| Synonyms | 1072946-31-6,
(4-Pentylcyclohex-1-en-1-yl)boronic acid,
4-Pentylcyclohex-1-enylboronic acid,
ACMC-2098rv,
CTK4A5247,
DTXSID60674488,
ANW-15641,
AKOS006302755,
RTR-001574,
OR360445,
AX8240000,
TR-001574,
Z7044,
A-4563,
I04-2262,
C11H21BO2,
(4-Pentylcyclohex-1-en-1-yl)boronicacid,
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| Complexity | 190 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 196.163g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 196.097g/mol |
| Monoisotopic Mass | 196.163g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 40.5A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number