Cas no 523990-84-3 (1-Pyrenepropanoic acid, 6-dodecyl-)
523990-84-3 structure
Product Name:1-Pyrenepropanoic acid, 6-dodecyl-
CAS No:523990-84-3
MF:C31H38O2
MW:442.632229328156
CID:359721
PubChem ID:71365653
Update Time:2025-04-19
1-Pyrenepropanoic acid, 6-dodecyl- Chemical and Physical Properties
Names and Identifiers
-
- 1-Pyrenepropanoic acid, 6-dodecyl-
- 3-(6-dodecylpyren-1-yl)propanoic acid
- 523990-84-3
- DTXSID10789051
-
- Inchi： 1S/C31H38O2/c1-2-3-4-5-6-7-8-9-10-11-12-23-13-15-25-18-21-28-24(19-22-29(32)33)14-16-26-17-20-27(23)30(25)31(26)28/h13-18,20-21H,2-12,19,22H2,1H3,(H,32,33)
- InChI Key： VOZNCBNAZBFNJM-UHFFFAOYSA-N
- SMILES： OC(CCC1=CC=C2C=CC3=C(C=CC4=CC=C1C2=C34)CCCCCCCCCCCC)=O
Computed Properties
- Exact Mass: 442.28734
- Monoisotopic Mass: 442.287180451g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 33
- Rotatable Bond Count: 14
- Complexity: 586
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 11
- Topological Polar Surface Area: 37.3?2
Experimental Properties
- PSA: 37.3
1-Pyrenepropanoic acid, 6-dodecyl- Related Literature
-
Kanjun Sun,Fengting Hua,Shuzhen Cui,Yanrong Zhu,Hui Peng,Guofu Ma RSC Adv., 2021,11, 37631-37642
-
Eunice Y.-L. Hui,Bhimsen Rout,Yaw Sing Tan,Kok-Ping Chan,Charles W. Johannes Org. Biomol. Chem., 2018,16, 389-392
-
Kaiyuan Huang,Wangkang Qiu,Meilian Ou,Xiaorui Liu,Zenan Liao,Sheng Chu RSC Adv., 2020,10, 18824-18829
-
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
523990-84-3 (1-Pyrenepropanoic acid, 6-dodecyl-) Related Products
- 3443-45-6(1-Pyrenebutyric acid)
- 4521-22-6(4-(p-Tolyl)butyric acid)
- 5581-75-9(6-Phenylhexanoic acid)
- 21658-35-5(3-(Naphthalen-2-yl)propanoic acid)
- 40228-90-8(7-Phenylheptanoic acid)
- 782-28-5(2-Naphthalenebutanoic Acid)
- 1821-12-1(4-Phenylbutyric acid)
- 2270-20-4(5-Phenylvaleric acid)
- 26547-51-3(8-Phenyloctanoic acid)
- 19629-78-8(Benzenehexadecanoicacid)
Recommended suppliers
HANGZHOU BAIS CHEMICAL TECHNOLOGY CO., LTD.
Gold Member
Audited Supplier
CN Supplier
Reagent
Wuhan Comings Biotechnology Co., Ltd.
Gold Member
Audited Supplier
CN Supplier
Bulk
Handan Zechi Trading Co., Ltd
Gold Member
Audited Supplier
CN Supplier
Bulk
Hubei Cuiyuan Biotechnology Co.,Ltd
Gold Member
Audited Supplier
CN Supplier
Reagent
煙臺朗裕新材料科技有限公司
Gold Member
Audited Supplier
CN Supplier
Reagent