| CAS Number | 13856-86-5 |
| Catalog Number | AG009GYS(AGN-PC-0PMZ8P) |
| Chemical Name | 1-(4-Chlorophenyl)butan-1-ol |
| EC Number | 237-592-7 |
| IUPAC Name | 1-(4-chlorophenyl)butan-1-ol |
| InChI | InChI=1S/C10H13ClO/c1-2-3-10(12)8-4-6-9(11)7-5-8/h4-7,10,12H,2-3H2,1H3 |
| InChI Key | HAELFEDVTLKJMU-UHFFFAOYSA-N |
| MDL Number | MFCD00021927 |
| Molecular Formula | C10H13ClO |
| Molecular Weight | 184.6626 |
| SMILES | c1c(ccc(c1)C(CCC)O)Cl |
| Synonyms | 1-(4-chlorophenyl)butan-1-ol,
13856-86-5,
4-Chloro-alpha-propylbenzyl alcohol,
1-(4-Chlorophenyl)-1-butanol,
HAELFEDVTLKJMU-UHFFFAOYSA-N,
EINECS 237-592-7,
AC1L3KAM,
SCHEMBL6690160,
4-Chloro-alpha-propylbenzenemethanol,
p-Chloro-.alpha.-propylbenzylalcohol,
AKOS009541375,
MCULE-7792098969,
FT-0618162,
C10H13ClO,
C10-H13-Cl-O,
CID117166,
|
| Complexity | 119 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 184.065g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 184.663g/mol |
| Monoisotopic Mass | 184.065g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 20.2A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number