5-Methyl-3-(nitromethyl)hexanoic Acid Ethyl Ester , CAS No.128013-65-0

Item Number
M347906
Grouped product items
SKUSizeAvailabilityPrice Qty
M347906-50mg
50mg
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$209.90

a Pregabalin intermediate

Basic Description

Synonymsstarbld0010817 | Hexanoic acid, 5-methyl-3-(nitromethyl)-, ethyl ester | J-005562 | 5-METHYL-3-(NITROMETHYL)HEXANOIC ACID ETHYL ESTER | 5-methyl-3-nitromethyl-hexanoic acid ethyl ester | LOHHVAYLSGONPS-UHFFFAOYSA-N | Ethyl (+/-)-3-nitromethyl-5-methylhexa
Storage TempStore at 2-8°C
Shipped InWet ice
Product Description

5-Methyl-3-(nitromethyl)hexanoic Acid Ethyl Ester is a Pregabalin intermediate.

Names and Identifiers

IUPAC Name ethyl 5-methyl-3-(nitromethyl)hexanoate
INCHI InChI=1S/C10H19NO4/c1-4-15-10(12)6-9(5-8(2)3)7-11(13)14/h8-9H,4-7H2,1-3H3
InChi Key LOHHVAYLSGONPS-UHFFFAOYSA-N
Canonical SMILES CCOC(=O)CC(CC(C)C)C[N+](=O)[O-]
Isomeric SMILES CCOC(=O)CC(CC(C)C)C[N+](=O)[O-]
PubChem CID 14463328
Molecular Weight 217.26

Certificates

Certificate of Analysis(COA)

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Chemical and Physical Properties

SolubilitySoluble in Chloroform, Ethyl Acetate and Methanol

Related Documents

Solution Calculators