| CAS Number | 4237-75-6 |
| Catalog Number | AG00CLM5(AGN-PC-0WCJYF) |
| Chemical Name | 3-Bromo-1,1-dimethylcyclobutane |
| IUPAC Name | 3-bromo-1,1-dimethylcyclobutane |
| InChI | InChI=1S/C6H11Br/c1-6(2)3-5(7)4-6/h5H,3-4H2,1-2H3 |
| InChI Key | YBYISQCMNIWGQJ-UHFFFAOYSA-N |
| MDL Number | MFCD20622253 |
| Molecular Formula | C6H11Br |
| Molecular Weight | 163.0555 |
| SMILES | CC1(C)CC(Br)C1 |
| Synonyms | 3-Bromo-1,1-dimethylcyclobutane,
4237-75-6,
1-bromo-3,3-dimethylcyclobutane,
3-bromo-1,1-dimethyl-cyclobutane,
SCHEMBL10934978,
DTXSID20578993,
ZINC95093147,
AKOS016014718,
SB13948,
AJ-132241,
ST2404916,
4CH-017736,
F2147-2334,
Cyclobutane, 3-bromo-1,1-dimethyl-,
|
| Complexity | 68.2 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 162.004g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 7 |
| Hydrogen Bond Acceptor Count | 0 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 163.058g/mol |
| Monoisotopic Mass | 162.004g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 0A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.7 |
GHS Hazard and Precautionary Statements
| Symbol: |   |
|
Hazard Class
|
3
|
|
Hazard statements
|
H225-H315-H319-H335
|
|
Packing Group
|
Ⅱ
|
|
Precautionary statements
|
P210-P261-P305+P351+P338
|
|
UN Code
|
UN 1993
|
Certificate of Analysis
Lot Number