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Structure

Rarechem aq a1 0061

CAS
62291-95-6
Catalog Number
ACM62291956
Category
Other Products
Molecular Weight
273.306
Molecular Formula
C11H15NO5S

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Specification

Synonyms
Maybridge1_004117, 2-Methyl-2-nitro-1-propyltosylate, HMS553D05, BRN 0890601, MolPort-002-904-403, CID112826, JFD 02758, ZINC02531008, LS-154173, 3-11-00-00190 (Beilstein Handbook Reference), p-Toluenesulfonic acid, (2-methyl-2-nitro)propyl ester, 1-Propanol, 2-methyl-2-nitro-, 4-methylbenzenesulfonate (ester), 1-Propanol, 2-methyl-2-nitro-, 4-methylbenzenesulfonate (ester) (9CI), 62291-95-6
IUPAC Name
(2-methyl-2-nitropropyl) 4-methylbenzenesulfonate
Canonical SMILES
CC1=CC=C(C=C1)S(=O)(=O)OCC(C)(C)[N+](=O)[O-]
InChI Key
JPBYZIPRNBTADS-UHFFFAOYSA-N
Boiling Point
415.6ºC at 760 mmHg
Flash Point
205.1ºC
Density
1.264g/cm³
Exact Mass
273.06700
H-Bond Acceptor
5
H-Bond Donor
0
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