Cas no 99952-49-5 ((S)-N-(2-(2-Formyl-1-pyrrolidinyl)-2-oxoethyl)acetamide)
99952-49-5 structure
Product Name:(S)-N-(2-(2-Formyl-1-pyrrolidinyl)-2-oxoethyl)acetamide
CAS No:99952-49-5
MF:C9H14N2O3
MW:198.219062328339
CID:1003097
PubChem ID:3063139
Update Time:2025-04-20
(S)-N-(2-(2-Formyl-1-pyrrolidinyl)-2-oxoethyl)acetamide Chemical and Physical Properties
Names and Identifiers
-
- (S)-N-(2-(2-Formyl-1-pyrrolidinyl)-2-oxoethyl)acetamide
- N-[2-[(2S)-2-formylpyrrolidin-1-yl]-2-oxoethyl]acetamide
- DTXSID30244359
- (S)-N-(2-(2-Formylpyrrolidin-1-yl)-2-oxoethyl)acetamide
- SCHEMBL2557245
- Acetyl-glycyl-prolinal
- 99952-49-5
- AKOS006277682
- HXPLRFNNPINGHP-QMMMGPOBSA-N
- Acetamide, N-(2-(2-formyl-1-pyrrolidinyl)-2-oxoethyl)-, (S)-
-
- Inchi： 1S/C9H14N2O3/c1-7(13)10-5-9(14)11-4-2-3-8(11)6-12/h6,8H,2-5H2,1H3,(H,10,13)/t8-/m0/s1
- InChI Key： HXPLRFNNPINGHP-QMMMGPOBSA-N
- SMILES： O=C(CNC(C)=O)N1CCC[C@H]1C=O
Computed Properties
- Exact Mass: 198.10044231g/mol
- Monoisotopic Mass: 198.10044231g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 14
- Rotatable Bond Count: 3
- Complexity: 252
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 1
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: -0.9
- Topological Polar Surface Area: 66.5?2
(S)-N-(2-(2-Formyl-1-pyrrolidinyl)-2-oxoethyl)acetamide Related Literature
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Craig A. Kelly,David R. Rosseinsky Phys. Chem. Chem. Phys., 2001,3, 2086-2090
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Joseph H. Bisesi,Tara Sabo-Attwood Environ. Sci.: Nano, 2014,1, 574-583
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Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
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4. Excimer emission and magnetoluminescence of radical-based zinc(ii) complexes doped in host crystals?Shojiro Kimura,Tetsuro Kusamoto Chem. Commun., 2020,56, 11195-11198
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Qiaoe Wang,Meiling Lian,Xiaowen Zhu,Xu Chen RSC Adv., 2021,11, 192-197
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