| CAS Number | 3722-69-8 |
| Catalog Number | AG007A67(AGN-PC-0WCZHJ) |
| Chemical Name | 8-Chlorochroman |
| IUPAC Name | 8-chloro-3,4-dihydro-2H-chromene |
| InChI | InChI=1S/C9H9ClO/c10-8-5-1-3-7-4-2-6-11-9(7)8/h1,3,5H,2,4,6H2 |
| InChI Key | CYSQTUPJQFEKES-UHFFFAOYSA-N |
| MDL Number | MFCD03695452 |
| Molecular Formula | C9H9ClO |
| Molecular Weight | 168.6202 |
| SMILES | ClC1=CC=CC2=C1OCCC2 |
| Synonyms | 8-Chlorochroman,
3722-69-8,
8-Chloro-3,4-dihydro-2H-1-benzopyran,
8-CHLOROCHROMANE,
SCHEMBL15319473,
CTK4H7935,
DTXSID30697780,
CYSQTUPJQFEKES-UHFFFAOYSA-N,
FCH847984,
MFCD03695452,
AKOS006279204,
ZINC104377764,
ACM3722698,
DS-3275,
AK552085,
AX8111237,
J3.665.819C,
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| Complexity | 138 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 168.034g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 168.62g/mol |
| Monoisotopic Mass | 168.034g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 9.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.9 |
GHS Hazard and Precautionary Statements
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Hazard Class
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Hazard statements
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H315-H319-H335
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Packing Group
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Precautionary statements
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P261-P305+P351+P338
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UN Code
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Certificate of Analysis
Lot Number