CAS
13360-98-0 Purity
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13360-98-0 Purity
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Isopropyl cyanoacetate
CAS
13361-30-3
Catalog Number
ACM13361303
Category
Other Products
Molecular Weight
127.14
Molecular Formula
C6H9NO2
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Specification
Synonyms
Isopropyl cyanoacetate, NSC 1071, 28452_FLUKA, EINECS 236-421-3, NSC1071, BRN 1756014, ZINC00164532, Acetic acid, cyano-, 1-methylethyl ester, ACETIC ACID, CYANO-, ISOPROPYL ESTER, CYANOACETIC ACID, ISOPROPYL ESTER, LS-11503, ST5410490, TL8000798, 3-02-00-01632 (Beilstein Handbook Reference), 13361-30-3
IUPAC Name
propan-2-yl 2-cyanoacetate
Canonical SMILES
CC(C)OC(=O)CC#N
InChI Key
BESQLCCRQYTQQI-UHFFFAOYSA-N
Boiling Point
207ºC
Flash Point
78.9ºC
Density
1.013
EC Number
236-421-3
Exact Mass
127.06300
Hazard Statements
Xi:Irritant;
H-Bond Acceptor
3
H-Bond Donor
0
Safety Description
S23-S26-S36/37/39
WGK Germany
2
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