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(3S,4S,5S)-4-ethyl-3-fluoro-5-(hydroxymethyl)pyrrolidin-2-one - 97%, high purity , CAS No.1817630-30-0

    Grade & Purity:
  • ≥97%
In stock
Item Number
E630657
Grouped product items
SKU Size
Availability
Price Qty
E630657-100mg
100mg
Available within 8-12 weeks(?)
Production requires sourcing of materials. We appreciate your patience and understanding.
$289.90
E630657-250mg
250mg
Available within 8-12 weeks(?)
Production requires sourcing of materials. We appreciate your patience and understanding.
$463.90
E630657-500mg
500mg
Available within 8-12 weeks(?)
Production requires sourcing of materials. We appreciate your patience and understanding.
$773.90
E630657-1g
1g
Available within 8-12 weeks(?)
Production requires sourcing of materials. We appreciate your patience and understanding.
$1,393.90

Basic Description

Synonyms 1817630-30-0 | (3S,4S,5S)-4-ethyl-3-fluoro-5-(hydroxymethyl)pyrrolidin-2-one | 2-Pyrrolidinone, 4-ethyl-3-fluoro-5-(hydroxymethyl)-, (3S,4S,5S)- | SCHEMBL17137407 | MFCD30802158 | AKOS037647000 | AS-71882 | P17957 | A937543
Specifications & Purity ≥97%
Shipped In Normal

Names and Identifiers

IUPAC Name (3S,4S,5S)-4-ethyl-3-fluoro-5-(hydroxymethyl)pyrrolidin-2-one
INCHI InChI=1S/C7H12FNO2/c1-2-4-5(3-10)9-7(11)6(4)8/h4-6,10H,2-3H2,1H3,(H,9,11)/t4-,5+,6-/m0/s1
InChIKey IGWNABXPHUHNJI-JKUQZMGJSA-N
Smiles CCC1C(NC(=O)C1F)CO
Isomeric SMILES CC[C@H]1[C@H](NC(=O)[C@H]1F)CO
PubChem CID 118414580
Molecular Weight 161.17

Certificates(CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:

Chemical and Physical Properties

Molecular Weight 161.170 g/mol
XLogP3 0.300
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 2
Exact Mass 161.085 Da
Monoisotopic Mass 161.085 Da
Topological Polar Surface Area 49.300 Ų
Heavy Atom Count 11
Formal Charge 0
Complexity 163.000
Isotope Atom Count 0
Defined Atom Stereocenter Count 3
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
The total count of all stereochemical bonds 0
Covalently-Bonded Unit Count 1

Solution Calculators

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