| CAS Number | 911060-82-7 |
| Catalog Number | AG00IGHI(AGN-PC-0WBKON) |
| Chemical Name | 1-(Hydroxymethyl)cyclopentanecarbonitrile |
| IUPAC Name | 1-(hydroxymethyl)cyclopentane-1-carbonitrile |
| InChI | InChI=1S/C7H11NO/c8-5-7(6-9)3-1-2-4-7/h9H,1-4,6H2 |
| InChI Key | XIONVAIUILQBNZ-UHFFFAOYSA-N |
| MDL Number | MFCD20260969 |
| Molecular Formula | C7H11NO |
| Molecular Weight | 125.1683 |
| SMILES | N#CC1(CO)CCCC1 |
| Synonyms | 1-(hydroxymethyl)cyclopentanecarbonitrile,
911060-82-7,
1-(hydroxymethyl)cyclopentane-1-carbonitrile,
Cyclopentanecarbonitrile, 1-(hydroxymethyl)-,
SCHEMBL101752,
XIONVAIUILQBNZ-UHFFFAOYSA-N,
ALBB-016805,
2904AF,
MFCD19103512,
ZINC49804394,
1-Hydroxymethylcyclopentanecarbonitrile,
AKOS015959824,
1-Hydroxymethyl-cyclopentanecarbonitrile,
MCULE-8187436672,
NE34368,
NS-01032,
Z1642058396,
C7H11NO,
|
| Complexity | 138 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 125.084g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 125.171g/mol |
| Monoisotopic Mass | 125.084g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 44A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.7 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number