Cas no 61340-16-7 (Benzoic acid, 2-amino-5-(phenylmethoxy)-, phenylmethyl ester)
61340-16-7 structure
Product Name:Benzoic acid, 2-amino-5-(phenylmethoxy)-, phenylmethyl ester
CAS No:61340-16-7
MF:C21H19NO3
MW:333.380465745926
CID:483342
PubChem ID:15520893
Update Time:2025-04-19
Benzoic acid, 2-amino-5-(phenylmethoxy)-, phenylmethyl ester Chemical and Physical Properties
Names and Identifiers
-
- Benzoic acid, 2-amino-5-(phenylmethoxy)-, phenylmethyl ester
- benzyl 2-amino-5-phenylmethoxybenzoate
- 2-Amino-5-benzyloxybenzoic acid benzyl ester
- DTXSID50573592
- 61340-16-7
- Benzyl 2-amino-5-(benzyloxy)benzoate
-
- Inchi： 1S/C21H19NO3/c22-20-12-11-18(24-14-16-7-3-1-4-8-16)13-19(20)21(23)25-15-17-9-5-2-6-10-17/h1-13H,14-15,22H2
- InChI Key： VIYOKNMTWMBBBP-UHFFFAOYSA-N
- SMILES： O(CC1C=CC=CC=1)C1=CC=C(C(C(=O)OCC2C=CC=CC=2)=C1)N
Computed Properties
- Exact Mass: 333.13657
- Monoisotopic Mass: 333.13649347g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 25
- Rotatable Bond Count: 7
- Complexity: 402
- 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: 4.6
- Topological Polar Surface Area: 61.6?2
Experimental Properties
- PSA: 61.55
Benzoic acid, 2-amino-5-(phenylmethoxy)-, phenylmethyl ester Related Literature
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Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
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Tao Wang,Yangyang Liu,Yue Deng,Hongbo Fu,Jianmin Chen Environ. Sci.: Nano, 2018,5, 1821-1833
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Dhirendra K. Chaudhary,Pramendra Kumar,Lokendra Kumar RSC Adv., 2016,6, 94731-94738
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Brindha J.,Balamurali M. M.,Kaushik Chanda RSC Adv., 2019,9, 34720-34734
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Joo Chuan Yeo,Kenry Lab Chip, 2016,16, 4082-4090
61340-16-7 (Benzoic acid, 2-amino-5-(phenylmethoxy)-, phenylmethyl ester) Related Products
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