| CAS Number | 1365272-27-0 |
| Catalog Number | AG00120M(AGN-PC-0J2C7W) |
| Chemical Name | 2-Bromo-1-butoxy-3-chlorobenzene |
| IUPAC Name | 2-bromo-1-butoxy-3-chlorobenzene |
| InChI | InChI=1S/C10H12BrClO/c1-2-3-7-13-9-6-4-5-8(12)10(9)11/h4-6H,2-3,7H2,1H3 |
| InChI Key | QYUJVMRLRCZFNB-UHFFFAOYSA-N |
| MDL Number | MFCD21609562 |
| Molecular Formula | C10H12BrClO |
| Molecular Weight | 263.5587 |
| SMILES | CCCCOc1cccc(c1Br)Cl |
| Synonyms | 2-Bromo-1-butoxy-3-chlorobenzene,
1365272-27-0,
ACMC-209c7r,
CTK8B0534,
DTXSID50742887,
ANW-20101,
MFCD21609562,
ZINC82046479,
Benzene, 2-bromo-1-butoxy-3-chloro-,
AJ-124174,
AX8240310,
TC-108846,
V2597,
K-4376,
C10H12BrClO,
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| Complexity | 143 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 261.976g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 263.559g/mol |
| Monoisotopic Mass | 261.976g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 9.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 4.5 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number