Products 61499-10-3

CAS 61499-10-3 appears in our catalog under these names: 4-Phenylbutyl Isothiocyanate, 4-Phenylbutyl isothiocyanate, 95% , PBITC. Offered by: TRC, Thermo Scientific, MedChemExpress. Available pack sizes: 5g, 1g, 10g, Get quote.

4-Phenylbutyl Isothiocyanate
TRC
  • size: 5g
  • Variants: 1
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4-Phenylbutyl isothiocyanate, 95%
Thermo Scientific
  • size: 1g, 10g
  • Variants: 2
from 319.19
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PBITC
MedChemExpress
  • size: Get quote
  • Variants: 1
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Structural formula: {0} (CAS {1})

1-Isothiocyanato-4-phenylbutane is a member of benzenes and an organic amino compound.

Source: ChEBI

Identity
Molecular formulaC11H13NS
Molecular weight191.29 g/mol
IUPAC name4-isothiocyanatobutylbenzene
InChIKeyCCBQOLFAKKAMLD-UHFFFAOYSA-N
SMILESC1=CC=C(C=C1)CCCCN=C=S

Computed by PubChem (NCBI)

Synonyms: 4-Phenylbutyl isothiocyanate, (4-isothiocyanatobutyl)benzene, 4-phenylbutylisothiocyanate, PBITC, 4-isothiocyanatobutylbenzene, Phenylbutyl isothiocyanate, 1-Isothiocyanato-4-phenylbutane, Benzene, (4-isothiocyanatobutyl)-, 4-phenylbutanisothiocyanate, orb2646296
Isomers (same molecular formula)
1-benzylpyrrolidine-2-thione C11H13NS
1,3-diethyl-2-isothiocyanatobenzene C11H13NS
N-(1-benzothiophen-2-ylmethyl)ethanamine C11H13NS
1-butyl-4-isothiocyanatobenzene C11H13NS
2-isothiocyanato-1-methyl-3-propan-2-ylbenzene C11H13NS
(4-tert-butylphenyl) thiocyanate C11H13NS
1-tert-butyl-2-isothiocyanatobenzene C11H13NS
2-(1-benzothiophen-2-yl)-N-methylethanamine C11H13NS
6-tert-butyl-1,3-benzothiazole C11H13NS
4-tert-butyl-1,3-benzothiazole C11H13NS
3,3-dimethyl-2-methylsulfanylindole C11H13NS
spiro[3H-1,3-benzothiazole-2,1'-cyclopentane] C11H13NS