544000

5-Hexynoic acid

97%

Manufacturer: Sigma Aldrich

CAS Number: 53293-00-8

Synonym(S): 4-Ethynylbutyric acid, 5-Hexyn-1-oic acid

Select a Size

Pack Size SKU Availability Price
5 G 544000-5-G In Stock ₹ 10,879.13
25 G 544000-25-G In Stock ₹ 26,856.83

544000 - 5 G

₹ 10,879.13

In Stock

Quantity

1

Base Price: ₹ 10,879.13

GST (18%): ₹ 1,958.243

Total Price: ₹ 12,837.373

Quality Level

100

Assay

97%

refractive index

n20/D 1.449 (lit.)

bp

224-225 °C (lit.)

density

1.016 g/mL at 25 °C (lit.)

SMILES string

OC(=O)CCCC#C

InChI

1S/C6H8O2/c1-2-3-4-5-6(7)8/h1H,3-5H2,(H,7,8)

InChI key

VPFMEXRVUOPYRG-UHFFFAOYSA-N

Description

  • General description: 5-Hexynoic acid is an alkynoic acid. It undergoes gold-catalyzed cyclization to form the corresponding methylene lactones.[1]
  • Application: 5-Hexynoic acid may be used in the preparation of:5-hexynoic acid methyl ester[2]5,6-dicarba-closo-dodecaboranyl hexynoic acid[2]5,8,11-dodecatriynoic acid[3]5-isocyanato-1-pentyne[4]

SAFETY INFORMATION

Pictograms

GHS07

Signal Word

Warning

Hazard Statements

H315,H319,H335

Precautionary Statements

P261 - P264 - P271 - P280 - P302 + P352 - P305 + P351 + P338

Hazard Classifications

Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3

Target Organs

Respiratory system

WGK

WGK 3

Flash Point(F)

230.0 °F

Flash Point(C)

110 °C

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

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refractive index:
n20/D 1.449 (lit.)

bp:
224-225 °C (lit.)

density:
1.016 g/mL at 25 °C (lit.)

SMILES string:
OC(=O)CCCC#C

InChI:
1S/C6H8O2/c1-2-3-4-5-6(7)8/h1H,3-5H2,(H,7,8)

InChI key:
VPFMEXRVUOPYRG-UHFFFAOYSA-N

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Cl.N[C@@H](CCc1ccccc1)C(O)=O

InChI:
1S/C10H13NO2.ClH/c11-9(10(12)13)7-6-8-4-2-1-3-5-8;/h1-5,9H,6-7,11H2,(H,12,13);1H/t9-;/m0./s1

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CHBMONIBOQCTCF-FVGYRXGTSA-N

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[Li]N(S(=O)(=O)C(F)(F)F)S(=O)(=O)C(F)(F)F

InChI:
1S/C2F6NO4S2.Li/c3-1(4,5)14(10,11)9-15(12,13)2(6,7)8;/q-1;+1

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QSZMZKBZAYQGRS-UHFFFAOYSA-N

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SMILES string:
O.[Ni++].O[Ni]O.O[Ni]O.[O-]C([O-])=O

InChI:
1S/CH2O3.3Ni.5H2O/c2-1(3)4;;;;;;;;/h(H2,2,3,4);;;;5*1H2/q;3*+2;;;;;/p-6

InChI key:
CCFAFYHXJQHIRV-UHFFFAOYSA-H