Cas no 127265-99-0 (methyl 8-chloro-4-hydroxy-naphthalene-2-carboxylate)
127265-99-0 structure
Product Name:methyl 8-chloro-4-hydroxy-naphthalene-2-carboxylate
CAS No:127265-99-0
MF:C12H9ClO3
MW:236.651062726974
CID:832414
Update Time:2026-04-29
methyl 8-chloro-4-hydroxy-naphthalene-2-carboxylate Chemical and Physical Properties
Names and Identifiers
-
- methyl 8-chloro-4-hydroxy-naphthalene-2-carboxylate
- 2-NAPHTHALENECARBOXYLIC ACID, 8-CHLORO-4-HYDROXY-, METHYL ESTER
- 8-CHLORO-4-HYDROXY-2-NAPHTHALENECARBOXYLIC ACID METHYL ESTER
- Methyl 8-chloro-4-hydroxy-2-naphthoate
- LogP
- Methyl-8-chlor-4-hydroxy-2-naphthoat
-
- Inchi： InChI=1S/C12H9ClO3/c1-16-12(15)7-5-9-8(11(14)6-7)3-2-4-10(9)13/h2-6,14H,1H3
- InChI Key： KVGWWTHPCSVNDM-UHFFFAOYSA-N
- SMILES： COC(=O)C1=CC2=C(C=CC=C2Cl)C(=C1)O
Computed Properties
- Exact Mass: 236.02407
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 16
- Rotatable Bond Count: 2
Experimental Properties
- PSA: 46.53
methyl 8-chloro-4-hydroxy-naphthalene-2-carboxylate Related Literature
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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Ivor Lon?ari? Phys. Chem. Chem. Phys., 2015,17, 9436-9445
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Thi Thu Tram Nguyen,Thanh Binh Nguyen Org. Biomol. Chem., 2021,19, 6015-6020
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Erika A. Cobar,Paul R. Horn,Robert G. Bergman,Martin Head-Gordon Phys. Chem. Chem. Phys., 2012,14, 15328-15339
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Zhixia Liu,Tingjian Chen,Floyd E. Romesberg Chem. Sci., 2017,8, 8179-8182
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