Cas no 70544-96-6 ((9cis,13cis)-(15-~14~C)retinoic acid)
70544-96-6 structure
Product Name:(9cis,13cis)-(15-~14~C)retinoic acid
CAS No:70544-96-6
MF:C20H28O2
MW:302.427667617798
CID:1744613
PubChem ID:6439661
Update Time:2025-04-21
(9cis,13cis)-(15-~14~C)retinoic acid Chemical and Physical Properties
Names and Identifiers
-
- (9cis,13cis)-(15-~14~C)retinoic acid
- 15-14C-Retinoic acid
- all-trans-(Carboxyl-14C)retinoic acid
- 70544-96-6
- Retinoic-15-14C acid
-
- Inchi： 1S/C20H28O2/c1-15(8-6-9-16(2)14-19(21)22)11-12-18-17(3)10-7-13-20(18,4)5/h6,8-9,11-12,14H,7,10,13H2,1-5H3,(H,21,22)/b9-6+,12-11+,15-8-,16-14-/i19+2
- InChI Key： SHGAZHPCJJPHSC-OPXHMNGOSA-N
- SMILES： O[14C](/C=C(/C)\C=C\C=C(\C)/C=C/C1=C(C)CCCC1(C)C)=O
Computed Properties
- Exact Mass: 302.21217212g/mol
- Monoisotopic Mass: 302.21217212g/mol
- Isotope Atom Count: 1
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 22
- Rotatable Bond Count: 5
- Complexity: 567
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 4
- Undefined Bond Stereocenter Count: 0
- XLogP3: 6.3
- Topological Polar Surface Area: 37.3?2
(9cis,13cis)-(15-~14~C)retinoic acid Related Literature
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Gang Pan,Yi-jie Bao,Jie Xu,Tao Liu,Cheng Liu,Yan-yan Qiu,Xiao-jing Shi,Hui Yu,Ting-ting Jia,Xia Yuan,Ze-ting Yuan,Yi-jun Cao RSC Adv., 2016,6, 42109-42119
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Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
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A. B. F. da Silva,K. Capelle Phys. Chem. Chem. Phys., 2009,11, 4564-4569
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Gaurav J. Shah,Eric P.-Y. Chiou,Ming C. Wu,Chang-Jin “CJ” Kim Lab Chip, 2009,9, 1732-1739
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