Cas no 40956-18-1 (2-Oxiranecarboxylicacid, 3-phenyl-, methyl ester, (2R,3R)-rel-)

2-Oxiranecarboxylicacid, 3-phenyl-, methyl ester, (2R,3R)-rel- structure
40956-18-1 structure
Product Name:2-Oxiranecarboxylicacid, 3-phenyl-, methyl ester, (2R,3R)-rel-
CAS No:40956-18-1
MF:C10H10O3
MW:178.184603214264
CID:331982
PubChem ID:146624
Update Time:2025-04-19

2-Oxiranecarboxylicacid, 3-phenyl-, methyl ester, (2R,3R)-rel- Chemical and Physical Properties

Names and Identifiers

    • 2-Oxiranecarboxylicacid, 3-phenyl-, methyl ester, (2R,3R)-rel-
    • methyl (2S,3S)-3-phenyloxirane-2-carboxylate
    • SCHEMBL9543017
    • UNII-D67P3Q9H97
    • (2S,3S)-(-)-3-PHENYLOXIRANECARBOXYLATE METHYL ESTER
    • 2-Oxiranecarboxylic acid, 3-phenyl-, methyl ester, (2S,3S)-
    • FEMA NO. 4654, CIS-(+/-)-
    • cis-Methylepoxycinnamate
    • Q27276160
    • (2S,3S)-(-)-3-Phenyloxiranecarboxylate(OMe)
    • CCRIS 1645
    • cis-(2S,3S)Methylepoxycinnamate
    • trans-(2S,3R)Methylepoxycinnamate
    • OXIRANECARBOXYLIC ACID, 3-PHENYL-, METHYL ESTER, CIS-
    • 115794-68-8
    • MFCD01709512
    • 40956-18-1
    • (2S,3S)-methyl 3-phenyloxirane-2-carboxylate
    • CCRIS 1649
    • METHYL .BETA.-PHENYLGLYCIDATE, CIS-(+/-)-
    • cis-(+/-)-methyl beta-phenylglycidate
    • methyl (2S,3R)-3-phenyloxirane-2-carboxylate
    • 115794-66-6
    • Methyl beta-phenylglycidate, cis-(+/-)-
    • 2-OXIRANECARBOXYLIC ACID, 3-PHENYL-, METHYL ESTER, (2R,3R)-REL-
    • D67P3Q9H97
    • Inchi: 1S/C10H10O3/c1-12-10(11)9-8(13-9)7-5-3-2-4-6-7/h2-6,8-9H,1H3/t8-,9-/m0/s1
    • InChI Key: HAFFKTJSQPQAPC-IUCAKERBSA-N
    • SMILES: O1[C@H](C(=O)OC)[C@@H]1C1C=CC=CC=1

Computed Properties

  • Exact Mass: 178.062994177g/mol
  • Monoisotopic Mass: 178.062994177g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 3
  • Complexity: 196
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 2
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 1.3
  • Topological Polar Surface Area: 38.8?2
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