Cas no 761386-09-8 (methyl (1S,3R)-3-aminocyclohexanecarboxylate)

methyl (1S,3R)-3-aminocyclohexanecarboxylate structure
761386-09-8 structure
Product Name:methyl (1S,3R)-3-aminocyclohexanecarboxylate
CAS No:761386-09-8
MF:C8H15NO2
MW:157.210202455521
MDL:MFCD20760321
CID:550093
PubChem ID:68466059
Update Time:2025-04-19

methyl (1S,3R)-3-aminocyclohexanecarboxylate Chemical and Physical Properties

Names and Identifiers

    • Cyclohexanecarboxylicacid, 3-amino-, methyl ester, (1R,3S)-rel-(+)-
    • Cyclohexanecarboxylic acid, 3-amino-, methyl ester, (1R,3S)-rel-(+)- (9CI)
    • methyl (1S,3R)-3-aminocyclohexanecarboxylate
    • (1S, 3R)-3-Amino-cyclohexanecarboxylic acid methyl ester
    • 761386-09-8
    • Methyl (1S,3R)-3-aminocyclohexane-1-carboxylate
    • cis-3-amino-cyclohexanecarboxylic acid methyl ester
    • cis-methyl 3-aminocyclohexanecarboxylate
    • methyl(1S,3R)-3-aminocyclohexane-1-carboxylate
    • (1S,3R)-methyl 3-aminocyclohexanecarboxylate
    • SCHEMBL2983518
    • EN300-6810866
    • ZMMITUCIAZVHCG-NKWVEPMBSA-N
    • MDL: MFCD20760321
    • Inchi: 1S/C8H15NO2/c1-11-8(10)6-3-2-4-7(9)5-6/h6-7H,2-5,9H2,1H3/t6-,7+/m0/s1
    • InChI Key: ZMMITUCIAZVHCG-NKWVEPMBSA-N
    • SMILES: O(C)C([C@H]1CCC[C@H](C1)N)=O

Computed Properties

  • Exact Mass: 157.110278721g/mol
  • Monoisotopic Mass: 157.110278721g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 2
  • Complexity: 147
  • 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: 0.4
  • Topological Polar Surface Area: 52.3?2

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