Cas no 143096-36-0 (Benzoic acid,6-amino-2-methoxy-3-methyl-, methyl ester)
143096-36-0 structure
Product Name:Benzoic acid,6-amino-2-methoxy-3-methyl-, methyl ester
CAS No:143096-36-0
MF:C10H13NO3
MW:195.215122938156
CID:108128
PubChem ID:19776901
Update Time:2025-04-18
Benzoic acid,6-amino-2-methoxy-3-methyl-, methyl ester Chemical and Physical Properties
Names and Identifiers
-
- Benzoic acid,6-amino-2-methoxy-3-methyl-, methyl ester
- Benzoic acid, 6-amino-2-methoxy-3-methyl-, methyl ester (9CI)
- SCHEMBL9447396
- Methyl 6-amino-2-methoxy-3-methylbenzoate
- 143096-36-0
-
- Inchi： 1S/C10H13NO3/c1-6-4-5-7(11)8(9(6)13-2)10(12)14-3/h4-5H,11H2,1-3H3
- InChI Key： OQUQHWKISPZMNU-UHFFFAOYSA-N
- SMILES： O(C)C1C(C(=O)OC)=C(C=CC=1C)N
Computed Properties
- Exact Mass: 195.08959
- Monoisotopic Mass: 195.09
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 14
- Rotatable Bond Count: 3
- Complexity: 208
- 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
- Topological Polar Surface Area: 61.6A^2
- XLogP3: 2
Experimental Properties
- PSA: 61.55
Benzoic acid,6-amino-2-methoxy-3-methyl-, methyl ester Related Literature
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Jialiang Yuan,Ran Dong,Yuan Li,Yang Liu,Zhuo Zheng,Yuxia Liu,Yan Sun,Benhe Zhong,Zhenguo Wu,Xiaodong Guo Chem. Commun., 2021,57, 13004-13007
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Hamid Heydari,Mohammad B. Gholivand New J. Chem., 2017,41, 237-244
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Bidou Wang,Xifeng Chen Analyst, 2014,139, 5695-5699
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Siquan Zhang,Shengyao Wang,Liping Guo,Hao Chen,Bien Tan,Shangbin Jin J. Mater. Chem. C, 2020,8, 192-200
143096-36-0 (Benzoic acid,6-amino-2-methoxy-3-methyl-, methyl ester) Related Products
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