1-tert-Butyl-4-isothiocyanatomethylbenzene
Also known as: 1-(1,1-Dimethylethyl)-4-(isothiocyanatomethyl)benzene, 1-tert-Butyl-4-isothiocyanatomethyl-benzene, 1-tert-butyl-4-(isothiocyanatomethyl)benzene, 1-tert-butyl-4-isothiocyanomethyl benzene, 4-t-BuPhCH2NCS, 4-t-butylbenzyl isothiocyanate, 4-tert-Butylbenzyl isothiocyanate, A5644, Benzene, 1-(1,1-dimethylethyl)-4-(isothiocyanatomethyl)-, para-tbutylbenzyl-isothiocyanate
1-tert-Butyl-4-isothiocyanatomethylbenzene (CAS 31088-81-0) is a compound in the Organic Acids category listed in the Jingsj chemical database. It has the molecular formula C12H15NS and a molecular weight of 205.31900 g/mol. Key properties include a boiling point of 296.2ºC at 760 mmHg, a density of 0.96 and a flash point of 137.1ºC. No supplier offers are currently listed; request a quote. Record last updated Aug 21, 2026.
- CAS No.
- 31088-81-0
- Jingsj CID
- J-1358318-1
- Molecular Formula
- C12H15NS
- Molecular Weight
- 205.31900 g/mol
- Category
- Organic Acids
- Last updated
- 8/21/2026
No offers for this compound yet.
Request a quotePhysicochemical Properties
| Boiling Point | 296.2ºC at 760 mmHg |
|---|---|
| Density | 0.96 |
| Flash Point | 137.1ºC |
| Exact Mass | 205.09300 |
| PSA | 44.45000 |
| LogP | 3.58690 |
| Refractive Index | 1.527 |
Customs & Trade Information
| HS Code | 2930909090 |
|---|---|
| Summary | 2930909090. other organo-sulphur compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0% |
Frequently Asked Questions
What is the CAS number of 1-tert-Butyl-4-isothiocyanatomethylbenzene?
The CAS number of 1-tert-Butyl-4-isothiocyanatomethylbenzene is 31088-81-0.
What are the molecular formula and molecular weight of 1-tert-Butyl-4-isothiocyanatomethylbenzene?
1-tert-Butyl-4-isothiocyanatomethylbenzene has molecular formula C12H15NS and molecular weight 205.31900 g/mol.
What are the upstream and downstream products of 1-tert-Butyl-4-isothiocyanatomethylbenzene?
For 1-tert-Butyl-4-isothiocyanatomethylbenzene, Upstream Products: 4-tert-Butylbenzylamine, Di-2-pyridyl thionocarbonate, Thiophosgene.
Data compiled from public chemical databases such as PubChem and supplier catalogs; supplier offers are provided by suppliers.
Last updated:
How to cite: Jingsj. "1-tert-Butyl-4-isothiocyanatomethylbenzene (CAS 31088-81-0)". Jingsj Chemical Database. https://www.jingsj.com/compound/J-1358318-1 (accessed 2026-11-09).
Data for reference only; verify product details with suppliers before purchase.