| CAS Number | 219764-66-6 |
| Catalog Number | AG01C30Q |
| Chemical Name | [2-Chloro-4-(propan-2-yloxy)phenyl]methanol |
| IUPAC Name | (2-chloro-4-propan-2-yloxyphenyl)methanol |
| InChI | InChI=1S/C10H13ClO2/c1-7(2)13-9-4-3-8(6-12)10(11)5-9/h3-5,7,12H,6H2,1-2H3 |
| InChI Key | UYLAIVUNFDQQDA-UHFFFAOYSA-N |
| MDL Number | MFCD09754643 |
| Molecular Formula | C10H13ClO2 |
| Molecular Weight | 200.6620 |
| SMILES | CC(OC1=CC(Cl)=C(CO)C=C1)C |
| Synonyms | 219764-66-6,
(2-chloro-4-propan-2-yloxyphenyl)methanol,
[2-chloro-4-(propan-2-yloxy)phenyl]methanol,
(2-chloro-4-isopropoxyphenyl)methanol,
SCHEMBL6305146,
UYLAIVUNFDQQDA-UHFFFAOYSA-N,
2-chloro-4-isopropoxybenzylalcohol,
2-Chloro-4-isopropoxybenzyl alcohol,
ZINC83225531,
AKOS022958784,
DA-32120,
Benzenemethanol, 2-chloro-4-(1-methylethoxy)-,
Z2306596417,
N/A,
|
| Complexity | 150 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 200.060407g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 200.66g/mol |
| Monoisotopic Mass | 200.060407g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 29.5Ų |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number