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531324

Sigma-Aldrich

(S)-(−)-α-Methylbenzyl isocyanide

96%

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About This Item

Linear Formula:
C6H5CH(CH3)NC
CAS Number:
21872-32-2
Molecular Weight:
131.17
MDL number:
MFCD02683482
UNSPSC Code:
12352116
PubChem Substance ID:
24877812
NACRES:
NA.22

Assay

96%

optical activity

[α]20/D −35°, neat

refractive index

n20/D 1.506 (lit.)

bp

220 °C (lit.)

density

0.97 g/mL at 25 °C (lit.)

storage temp.

2-8°C

SMILES string

C[C@H]([N+]#[C-])c1ccccc1

InChI

1S/C9H9N/c1-8(10-2)9-6-4-3-5-7-9/h3-8H,1H3/t8-/m0/s1

InChI key

KCCAPMXVCPVFEH-QMMMGPOBSA-N

Related Categories

Pictograms

Exclamation mark
GHS07

Signal Word

Warning

Hazard Classifications

Acute Tox. 4 Dermal - Acute Tox. 4 Inhalation - Acute Tox. 4 Oral - Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3

Target Organs

Respiratory system

Storage Class Code

10 - Combustible liquids

WGK

WGK 3

Flash Point(F)

192.2 °F - closed cup

Flash Point(C)

89 °C - closed cup

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Certificates of Analysis (COA)

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