Cas no 147235-94-7 (3-Pyrrolidineaceticacid, 5-carboxy-, (3S,5S)-)
147235-94-7 structure
Product Name:3-Pyrrolidineaceticacid, 5-carboxy-, (3S,5S)-
CAS No:147235-94-7
MF:C7H11NO4
MW:173.166542291641
CID:100830
PubChem ID:11196944
Update Time:2025-04-18
3-Pyrrolidineaceticacid, 5-carboxy-, (3S,5S)- Chemical and Physical Properties
Names and Identifiers
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- 3-Pyrrolidineaceticacid, 5-carboxy-, (3S,5S)-
- 3-Pyrrolidineaceticacid,5-carboxy-,(3S,5S)-(9CI)
- 147235-94-7
- (2S,4S)-4-(Carboxymethyl)pyrrolidine-2-carboxylic acid
-
- Inchi： 1S/C7H11NO4/c9-6(10)2-4-1-5(7(11)12)8-3-4/h4-5,8H,1-3H2,(H,9,10)(H,11,12)/t4-,5-/m0/s1
- InChI Key： QNMBUGAPKCBEDP-WHFBIAKZSA-N
- SMILES： OC([C@@H]1C[C@@H](CC(=O)O)CN1)=O
Computed Properties
- Exact Mass: 173.06883
- Monoisotopic Mass: 173.06880783g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 12
- Rotatable Bond Count: 3
- Complexity: 204
- 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: -3
- Topological Polar Surface Area: 86.6?2
Experimental Properties
- PSA: 86.63
3-Pyrrolidineaceticacid, 5-carboxy-, (3S,5S)- Related Literature
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Dan Yang,Yanping Zhou,Xianhong Rui,Jixin Zhu,Ziyang Lu,Eileen Fong,Qingyu Yan RSC Adv., 2013,3, 14960-14962
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Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
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Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
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David White,Sean R. Stowell Biomater. Sci., 2017,5, 463-474
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Qiao Song,Angela Bamesberger,Lingyun Yang,Haley Houtwed,Haishi Cao Analyst, 2014,139, 3588-3592
147235-94-7 (3-Pyrrolidineaceticacid, 5-carboxy-, (3S,5S)-) Related Products
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- 72000-65-8(2,5-Pyrrolidinedicarboxylicacid)
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- 609-36-9(pyrrolidine-2-carboxylic acid)
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- 344-25-2(D-Proline)
- 2098070-20-1(2-(3-(Pyridin-3-yl)-1H-pyrazol-1-yl)acetimidamide)
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