Cas no 30954-98-4 (Benzoic acid, 2-amino-,propyl ester)
30954-98-4 structure
Product Name:Benzoic acid, 2-amino-,propyl ester
CAS No:30954-98-4
MF:C10H13NO2
MW:179.215722799301
CID:311405
PubChem ID:95016
Update Time:2025-04-19
Benzoic acid, 2-amino-,propyl ester Chemical and Physical Properties
Names and Identifiers
-
- Benzoic acid, 2-amino-,propyl ester
- propyl 2-aminobenzoate
- propyl anthranilate
- anthranilic acid-n-propyl ester
- NSC 13702
- AI3-02576
- SCHEMBL1477706
- NSC13702
- NS00028999
- DTXSID00184935
- 30954-98-4
- aminobenzoic acid ethylmethylester
- NFC6UJU5RN
- Anthranilic acid, propyl ester
- Benzoic acid, 2-amino-, propyl ester
- NSC-13702
- AKOS009166068
- Benzoic acid, amino-, propyl ester
-
- Inchi： 1S/C10H13NO2/c1-2-7-13-10(12)8-5-3-4-6-9(8)11/h3-6H,2,7,11H2,1H3
- InChI Key： QYGHESHPPSSONP-UHFFFAOYSA-N
- SMILES： O(C(C1C=CC=CC=1N)=O)CCC
Computed Properties
- Exact Mass: 179.09469
- Monoisotopic Mass: 179.095
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 13
- Rotatable Bond Count: 4
- Complexity: 170
- 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: 3.1
- Topological Polar Surface Area: 52.3?2
Experimental Properties
- Density: 1.798g/cm3
- Boiling Point: °Cat760mmHg
- Flash Point: °C
- Refractive Index: 1.546
- PSA: 52.32
- LogP: 2.41680
Benzoic acid, 2-amino-,propyl ester Related Literature
-
Ana G. Neo,Ana Bornadiego,Jesús Díaz,Stefano Marcaccini,Carlos F. Marcos Org. Biomol. Chem., 2013,11, 6546-6555
-
David White,Sean R. Stowell Biomater. Sci., 2017,5, 463-474
-
Chung-Sung Yang,Mong-Shian Shih,Fang-Yi Chang New J. Chem., 2006,30, 729-735
30954-98-4 (Benzoic acid, 2-amino-,propyl ester) Related Products
- 60728-41-8(3-Amino-4-(methoxycarbonyl)benzoic acid)
- 22223-49-0(2-Amino-3-methylbenzoic Acid Methyl Ester)
- 18595-16-9(Methyl 2-amino-5-methylbenzoate)
- 87-25-2(Ethyl anthranilate)
- 5372-81-6(1,4-dimethyl 2-aminobenzene-1,4-dicarboxylate)
- 94-12-2(Propyl 4-Aminobenzoate)
- 40800-65-5(Ethyl 4-amino-3-methylbenzoate)
- 18189-02-1(Isopropyl anthranilate)
- 133-18-6(Benzoic acid, 2-amino-,2-phenylethyl ester)
- 134-20-3(Methyl anthranilate)
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