| CAS Number | 68578-50-7 |
| Catalog Number | AG00FGYV(AGN-PC-0WOIYG) |
| Chemical Name | 1-Chloro-3-(ethoxymethyl)benzene |
| IUPAC Name | 1-chloro-3-(ethoxymethyl)benzene |
| InChI | InChI=1S/C9H11ClO/c1-2-11-7-8-4-3-5-9(10)6-8/h3-6H,2,7H2,1H3 |
| InChI Key | VGIVTNAZPRDSGW-UHFFFAOYSA-N |
| MDL Number | MFCD23699511 |
| Molecular Formula | C9H11ClO |
| Molecular Weight | 170.6360 |
| SMILES | CCOCc1cccc(c1)Cl |
| Synonyms | 1-chloro-3-(ethoxymethyl)benzene,
68578-50-7,
SCHEMBL30385,
ZINC95495759,
V7289,
K-6863,
C9H11ClO,
2655-83-6,
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| Complexity | 106 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 170.049843g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 170.63g/mol |
| Monoisotopic Mass | 170.049843g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 9.2Ų |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.8 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number