| CAS Number | 3814-32-2 |
| Catalog Number | AG00CLDY(AGN-PC-03X64Y) |
| Chemical Name | Cycloheptane, (bromomethyl)- |
| IUPAC Name | bromomethylcycloheptane |
| InChI | InChI=1S/C8H15Br/c9-7-8-5-3-1-2-4-6-8/h8H,1-7H2 |
| InChI Key | ZPGBMJCYYSEZBK-UHFFFAOYSA-N |
| MDL Number | MFCD12025292 |
| Molecular Formula | C8H15Br |
| Molecular Weight | 191.1087 |
| SMILES | BrCC1CCCCCC1 |
| Synonyms | (bromomethyl)cycloheptane,
3814-32-2,
cycloheptylmethyl bromide,
Bromomethylcycloheptane,
1-(bromomethyl)cycloheptane,
Cycloheptane, (bromomethyl)-,
SCHEMBL2961995,
ZPGBMJCYYSEZBK-UHFFFAOYSA-N,
ZINC54711048,
AKOS012020727,
NE15370,
AJ-112327,
(BROMOMETHYL)-CYCLOHEPTANE,
|
| Complexity | 63 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 190.036g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 0 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 191.112g/mol |
| Monoisotopic Mass | 190.036g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 0A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.9 |
GHS Hazard and Precautionary Statements
| Symbol: |  |
|
Hazard Class
|
\N
|
|
Hazard statements
|
H315-H319-H335-H227
|
|
Packing Group
|
\N
|
|
Precautionary statements
|
P210-P261-P264-P271-P280-P302+P352-P304+P340-P305+P351+P338-P312-P332+P313-P337+P313-P362-P370+P378-P403+P233-P403+P235-P405-P501
|
|
UN Code
|
\N
|
Certificate of Analysis
Lot Number