Cas no 14369-90-5 (2-Butenoic acid, 3-amino-2-methyl-, ethyl ester)
14369-90-5 structure
Product Name:2-Butenoic acid, 3-amino-2-methyl-, ethyl ester
CAS No:14369-90-5
MF:C7H13NO2
MW:143.183622121811
CID:1313956
PubChem ID:57348428
Update Time:2025-04-20
2-Butenoic acid, 3-amino-2-methyl-, ethyl ester Chemical and Physical Properties
Names and Identifiers
-
- 2-Butenoic acid, 3-amino-2-methyl-, ethyl ester
- METHYL 3-AMINO-2-METHYLCROTONATE
- Ethyl 3-amino-2-methylbut-2-enoate
- AHHWYDQKFSHGNI-UHFFFAOYSA-N
- 54393-21-4
- (Z)-3-Amino-2-methyl-2-butenoic Acid Ethyl Ester
- methyl 3-Amino-but-2-enoic acid ethyl ester
- AKOS030256000
- 14369-90-5
-
- Inchi： 1S/C7H13NO2/c1-4-10-7(9)5(2)6(3)8/h4,8H2,1-3H3
- InChI Key： AHHWYDQKFSHGNI-UHFFFAOYSA-N
- SMILES： O(CC)C(C(C)=C(C)N)=O
Computed Properties
- Exact Mass: 143.09469
- Monoisotopic Mass: 143.094628657g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 10
- Rotatable Bond Count: 3
- Complexity: 161
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 1
- XLogP3: 1.3
- Topological Polar Surface Area: 52.3?2
Experimental Properties
- PSA: 52.32
2-Butenoic acid, 3-amino-2-methyl-, ethyl ester 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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Peiyuan Zeng,Xiaoxiao Wang,Ming Ye,Qiuyang Ma,Jianwen Li,Wanwan Wang,Baoyou Geng,Zhen Fang RSC Adv., 2016,6, 23074-23084
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Guang Xu,Wei Zhang,Ying Zhang,Xiaoxia Zhao,Ping Wen,Di Ma RSC Adv., 2018,8, 19353-19361
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4. Excimer emission and magnetoluminescence of radical-based zinc(ii) complexes doped in host crystals?Shojiro Kimura,Tetsuro Kusamoto Chem. Commun., 2020,56, 11195-11198
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Manickam Bakthadoss,Tadiparthi Thirupathi Reddy,Vishal Agarwal,Duddu S. Sharada Chem. Commun., 2022,58, 1406-1409
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