Basic information
- CAS
73623-18-4- Standard SMILES
CC(C)CCOC(=O)Nc1cccc(O)c1- InChIKey
XQGRRRUKOWQZKI-UHFFFAOYSA-N- Molecular formula
- C12H17NO3
- Average molar mass
- 223.27 g/mol
- Monoisotopic mass
- 223.1208434
Names & identifiers
- Preferred name
- Carbanilic acid, m-hydroxy-, isopentyl ester
- IUPAC
- 3-methylbutyl N-(3-hydroxyphenyl)carbamate
- English name
- m-Hydroxycarbanilic acid isopentyl ester
- Molecular weight
- 0
Names & synonyms
73623-18-4CARBANILIC ACID, m-HYDROXY-, ISOPENTYL ESTERCarbamic acid, (3-hydroxyphenyl)-, 3-methylbutyl esterBWR2TNR22BNSC-222634Isopentyl 3-hydroxycarbanilateDTXSID90223827RefChem:1081096DTXCID201463183-methylbutyl N-(3-hydroxyphenyl)carbamateIsopentyl m-hydroxycarbanilatem-Hydroxycarbanilic acid isopentyl ester
Show more names
Isopentyl (3-hydroxyphenyl)carbamateNSC 222634orb1986293Carbanilic acid, isopentyl esterCarbamic acid, 3-methylbutyl esterNSC222634AKOS0299388443-Methylbutyl (3-hydroxyphenyl)carbamate
Database identifiers
- CAS
73623-18-4- PubChem CID
- 51906
- DTXSID
DTXSID90223827- UNII
- BWR2TNR22B
- Nikkaji
- J69.445B
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 58.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 218
Chemistry & industry
Suppliers2 total
TargetMol中国（陶术生物）15002134094 · [email protected]
上海陶术生物科技股份有限公司+1-781-999-5354 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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