Pentyl isocyanate

CAS：3954-13-0 | Pentyl isocyanate | Whchem

CAS: 3954-13-0

Other Names

1-PENTYL ISOCYANATE;N-PENTYL ISOCYANATE;PENTYL ISOCYANATE;PENTYL ISOCYANATE 98%;1-Pentylisocyanate,97%;Pentyl isocyanate,98%;Pentane, 1-isocyanato-

Molecular Formula

Purity

>97%

Molecular Weight

113.16 g/mol

EINECS

Structure Available Verified Product

English Name	Pentyl isocyanate
English Synonyms	1-PENTYL ISOCYANATE;N-PENTYL ISOCYANATE;PENTYL ISOCYANATE;PENTYL ISOCYANATE 98%;1-Pentylisocyanate,97%;Pentyl isocyanate,98%;Pentane, 1-isocyanato-
CAS Number	3954-13-0
Molecular Formula	C6H11NO
Molecular Weight	113.16 g/mol
EINECS Number
Related Categories	Isocyanates;Nitrogen Compounds;Organic Building Blocks;Building Blocks;Chemical Synthesis;Nitrogen Compounds;Organic Building Blocks
Mol File	Download MOL File
Structure Image

Property	Value
Boiling point	136-137 °C (lit.)
Density	0.878 g/mL at 25 °C (lit.)
Refractive index	n20/D 1.414 (lit.)
Flash point	90 °F
Storage condition	Flammables area
Form	Liquid
Color	Transparent colorless
Sensitivity	Moisture Sensitive
BRN	1746688
InChI	InChI=1S/C6H11NO/c1-2-3-4-5-7-6-8/h2-5H2,1H3
InChIKey	VRVUKQWNRPNACD-UHFFFAOYSA-N
SMILES	CCCCCN=C=O

Category	Value
Hazard Symbol	Xn
Hazard Codes (R Phrases)	10-20/21/22-36/37/38-41
Safety Codes (S Phrases)	16-26-36/37/39-45
UN Number	UN 3080 6.1/PG 2
WGK Germany	3
Hazard Class	6.1
Packing Group	II
HS Code (Customs)	29291090
Storage Category	3 - Flammable liquids
Hazard Classification	Acute Toxicity Category 4 (Dermal), Acute Toxicity Category 4 (Inhalation), Serious Eye Damage Category 1, Flammable Liquid Category 3, Respiratory Sensitizer Category 1, Dermal Irritation Category 2, Skin Sensitizer Category 1, Specific Target Organ Toxicity - Single Exposure Category 3

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