Cas no 83477-74-1 (BUTANEDIOIC ACID, HYDROXY-, 1-(PHENYLMETHYL) ESTER, (2R)-)
83477-74-1 structure
Product Name:BUTANEDIOIC ACID, HYDROXY-, 1-(PHENYLMETHYL) ESTER, (2R)-
CAS No:83477-74-1
MF:C11H12O5
MW:224.209983825684
CID:3403292
PubChem ID:11075036
Update Time:2025-04-21
BUTANEDIOIC ACID, HYDROXY-, 1-(PHENYLMETHYL) ESTER, (2R)- Chemical and Physical Properties
Names and Identifiers
-
- BUTANEDIOIC ACID, HYDROXY-, 1-(PHENYLMETHYL) ESTER, (2R)-
- Butanedioic acid, 2-hydroxy-, 1-(phenylmethyl) ester, (2R)-
- 83477-74-1
- G81781
- SCHEMBL1133837
- IHBVXNKKIAKFQI-SECBINFHSA-N
- D-malic acid monobenzyl ester
- (R)-4-(Benzyloxy)-3-hydroxy-4-oxobutanoic acid
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- Inchi： 1S/C11H12O5/c12-9(6-10(13)14)11(15)16-7-8-4-2-1-3-5-8/h1-5,9,12H,6-7H2,(H,13,14)/t9-/m1/s1
- InChI Key： IHBVXNKKIAKFQI-SECBINFHSA-N
- SMILES： C(OCC1=CC=CC=C1)(=O)[C@H](O)CC(O)=O
Computed Properties
- Exact Mass: 224.06847348Da
- Monoisotopic Mass: 224.06847348Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 16
- Rotatable Bond Count: 6
- Complexity: 245
- 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: 0.5
- Topological Polar Surface Area: 83.8?2
BUTANEDIOIC ACID, HYDROXY-, 1-(PHENYLMETHYL) ESTER, (2R)- Related Literature
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2. An integrated chip for immunofluorescence and its application to analyze lysosomal storage disordersJie Shen,Ying Zhou,Tu Lu,Junya Peng,Zhixiang Lin,Yuhong Pang,Li Yu Lab Chip, 2012,12, 317-324
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Philipp Traber,Stephan Kupfer,Stefanie Gr?fe,Isabelle Baussanne,Martine Demeunynck,Jean-Marie Mouesca,Serge Gambarelli,Vincent Artero,Murielle Chavarot-Kerlidou Chem. Sci., 2018,9, 4152-4159
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Priyambada Nayak,Tanmaya Badapanda,Anil Kumar Singh,Simanchalo Panigrahi RSC Adv., 2017,7, 16319-16331
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Adeline Huiling Loo,Alessandra Bonanni,Martin Pumera Analyst, 2013,138, 467-471
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