Cas no 1083-98-3 (Phosphonic acid,P-(phenylmethyl)-, bis(1-methylethyl) ester)
1083-98-3 structure
Product Name:Phosphonic acid,P-(phenylmethyl)-, bis(1-methylethyl) ester
CAS No:1083-98-3
MF:C13H21O3P
MW:256.277805089951
CID:181169
PubChem ID:305790
Update Time:2025-04-19
Phosphonic acid,P-(phenylmethyl)-, bis(1-methylethyl) ester Chemical and Physical Properties
Names and Identifiers
-
- Phosphonic acid,P-(phenylmethyl)-, bis(1-methylethyl) ester
- di(propan-2-yloxy)phosphorylmethylbenzene
- AC1L77LM
- Benzyl-phosphonic acid diisopropyl ester
- dipropan-2-yl benzylphosphonate
- MolPort-002-568-468
- NSC202851
- STL298112
- STOCK2S-53743
- phosphonic acid, P-(phenylmethyl)-, bis(1-methylethyl) ester
- 1083-98-3
- Benzylphosphonic acid diisopropyl ester
- VULUBVNRKILAME-UHFFFAOYSA-N
- AKOS003602157
- DTXSID10308261
- SR-01000325493
- NSC-202851
- SCHEMBL5403459
- SR-01000325493-1
-
- Inchi： 1S/C13H21O3P/c1-11(2)15-17(14,16-12(3)4)10-13-8-6-5-7-9-13/h5-9,11-12H,10H2,1-4H3
- InChI Key： VULUBVNRKILAME-UHFFFAOYSA-N
- SMILES： P(CC1C=CC=CC=1)(=O)(OC(C)C)OC(C)C
Computed Properties
- Exact Mass: 256.12293
- Monoisotopic Mass: 256.12283153g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 17
- Rotatable Bond Count: 6
- Complexity: 243
- 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: 2.6
- Topological Polar Surface Area: 35.5?2
Experimental Properties
- PSA: 35.53
- LogP: 4.22970
Phosphonic acid,P-(phenylmethyl)-, bis(1-methylethyl) ester Related Literature
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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
-
Jing Yu,Yu-Qi Lyu,Jiapeng Liu,Mohammed B. Effat,Junxiong Wu J. Mater. Chem. A, 2019,7, 17995-18002
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5. 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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