Cas no 14508-12-4 (Androsta-4,16-dien-3-one,16-acetyl- (6CI,8CI,9CI))
14508-12-4 structure
Product Name:Androsta-4,16-dien-3-one,16-acetyl- (6CI,8CI,9CI)
CAS No:14508-12-4
MF:C21H28O2
MW:312.445826530457
CID:226868
PubChem ID:11324427
Update Time:2025-04-19
Androsta-4,16-dien-3-one,16-acetyl- (6CI,8CI,9CI) Chemical and Physical Properties
Names and Identifiers
-
- Androsta-4,16-dien-3-one,16-acetyl- (6CI,8CI,9CI)
- 16-acetylandrosta-4,16-dien-3-one
- 16-Acetylandrosta-4,16-dien-3-on
- 16-acetyl-androsta-4,16-dien-3-one
- Einecs 238-516-5
- 14508-12-4
- (8S,9S,10R,13S,14S)-16-acetyl-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15-decahydrocyclopenta[a]phenanthren-3-one
- NS00053796
-
- Inchi： 1S/C21H28O2/c1-13(22)14-10-19-17-5-4-15-11-16(23)6-9-21(15,3)18(17)7-8-20(19,2)12-14/h11-12,17-19H,4-10H2,1-3H3/t17-,18+,19+,20-,21+/m1/s1
- InChI Key： CCRSVRNLGHVPMG-IFLJBQAJSA-N
- SMILES： O=C1C=C2CC[C@H]3[C@@H]4CC(C(C)=O)=C[C@@]4(C)CC[C@@H]3[C@@]2(C)CC1
Computed Properties
- Exact Mass: 312.20900
- Monoisotopic Mass: 312.209
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 23
- Rotatable Bond Count: 1
- Complexity: 640
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 5
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 34.1A^2
- XLogP3: 3.9
Experimental Properties
- Density: 1.1
- Boiling Point: 461°Cat760mmHg
- Flash Point: 171.5°C
- Refractive Index: 1.557
- PSA: 34.14000
- LogP: 4.64360
Androsta-4,16-dien-3-one,16-acetyl- (6CI,8CI,9CI) Related Literature
-
Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
-
Guiying Zhang,Maosheng Cheng,Yanni Li,Keliang Liu,Lifeng Cai Chem. Commun., 2013,49, 11086-11088
-
Maomao Hou,Fenglin Zhong,Qiu Jin,Enjiang Liu,Jie Feng,Tengyun Wang,Yue Gao RSC Adv., 2017,7, 34392-34400
-
Qiyuan Wu,Shangmin Xiong,Peichuan Shen,Shen Zhao,Alexander Orlov Catal. Sci. Technol., 2015,5, 2059-2064
Recommended suppliers
Zhengzhou Baoyu Pharmaceutical Co., Ltd.
Gold Member
Audited Supplier
CN Supplier
Bulk
Jiangsu Xinsu New Materials Co., Ltd
Gold Member
Audited Supplier
CN Supplier
Bulk
Shandong Jing Kun Chemical Co.,Ltd.
Gold Member
Audited Supplier
CN Supplier
Bulk
Yunnanjiuzhen
Gold Member
Audited Supplier
CN Supplier
Bulk
SunaTech Inc.
Gold Member
Audited Supplier
CN Supplier
Reagent
