| CAS Number | 1260010-40-9 |
| Catalog Number | AG000QP8(AGN-PC-0WANEY) |
| Chemical Name | 1(2H)-Naphthalenone, 5-bromo-3,4-dihydro-6-methyl- |
| IUPAC Name | 5-bromo-6-methyl-3,4-dihydro-2H-naphthalen-1-one |
| InChI | InChI=1S/C11H11BrO/c1-7-5-6-8-9(11(7)12)3-2-4-10(8)13/h5-6H,2-4H2,1H3 |
| InChI Key | YOUAHYWXCCBPNP-UHFFFAOYSA-N |
| MDL Number | MFCD18208391 |
| Molecular Formula | C11H11BrO |
| Molecular Weight | 239.1084 |
| SMILES | O=C1CCCC2=C1C=CC(C)=C2Br |
| Synonyms | 1260010-40-9,
5-Bromo-6-methyl-3,4-dihydronaphthalen-1(2H)-one,
5-BROMO-6-METHYL-1,2,3,4-TETRAHYDRONAPHTHALEN-1-ONE,
AMOT0599,
MFCD18208391,
AKOS025395701,
ZINC238486473,
FCH1364456,
AK172629,
AX8297033,
FT-0748494,
5-bromo-6-methyl-3,4-dihydro-2H-naphthalen-1-one,
1(2H)-Naphthalenone, 5-bromo-3,4-dihydro-6-methyl-,
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| Complexity | 214 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 237.999g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 239.112g/mol |
| Monoisotopic Mass | 237.999g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 17.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.1 |
GHS Hazard and Precautionary Statements
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Hazard Class
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Hazard statements
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H302-H315-H319
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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