Cas no 131086-92-5 (3,4-dihydroxy-6H-benzo[c]chromen-6-one)
131086-92-5 structure
Product Name:3,4-dihydroxy-6H-benzo[c]chromen-6-one
CAS No:131086-92-5
MF:C13H8O4
MW:228.200223922729
CID:1232002
PubChem ID:5488046
Update Time:2025-04-20
3,4-dihydroxy-6H-benzo[c]chromen-6-one Chemical and Physical Properties
Names and Identifiers
-
- 3,4-dihydroxy-6H-benzo[c]chromen-6-one
- 6H-Dibenzo(b,d)pyran-6-one, 3,4-dihydroxy-
- 3,4-dihydroxybenzo[c]chromen-6-one
- DTXSID30156882
- XVLDXKNPWFEZHU-UHFFFAOYSA-N
- BDBM50215359
- 131086-92-5
- 3,4-Dihydroxy-6-H-dibenzo(b,d)pyran-6-one
- SCHEMBL7987277
- CHEMBL6364
-
- Inchi: 1S/C13H8O4/c14-10-6-5-8-7-3-1-2-4-9(7)13(16)17-12(8)11(10)15/h1-6,14-15H
- InChI Key: XVLDXKNPWFEZHU-UHFFFAOYSA-N
- SMILES: O1C(C2C=CC=CC=2C2C=CC(=C(C1=2)O)O)=O
Computed Properties
- Exact Mass: 228.04224
- Monoisotopic Mass: 228.04225873g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 17
- Rotatable Bond Count: 0
- Complexity: 317
- 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: 2.3
- Topological Polar Surface Area: 66.8?2
Experimental Properties
- PSA: 66.76
3,4-dihydroxy-6H-benzo[c]chromen-6-one 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
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Gaurav J. Shah,Eric P.-Y. Chiou,Ming C. Wu,Chang-Jin “CJ” Kim Lab Chip, 2009,9, 1732-1739
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Jason Wan Lab Chip, 2020,20, 4528-4538
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Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
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