Basic information
- CAS
76727-28-1- Standard SMILES
OCC1COc2ccccc2C1- InChIKey
UPDSWAQIQZFOLF-UHFFFAOYSA-N- Molecular formula
- C10H12O2
- Average molar mass
- 164.2 g/mol
- Monoisotopic mass
- 164.08372962
Names & identifiers
- Preferred name
- 3,4-dihydro-2H-chromen-3-ylmethanol
- IUPAC
- 3,4-dihydro-2H-chromen-3-ylmethanol
- English name
- 3,4-DIHYDRO-2H-CHROMEN-3-YLMETHANOL
- Molecular formula
- C10H12O2
- Molecular weight
- 164.2
Names & synonyms
76727-28-13,4-dihydro-2H-chromen-3-ylmethanolDTXSID40383682RefChem:270997DTXCID50334706CHROMAN-3-YLMETHANOL(3,4-Dihydro-2h-1-benzopyran-3-yl)methanolMFCD049726412H-1-Benzopyran-3-methanol,3,4-dihydro-3-hydroxymethylchromanchroman-3-yl-methanolchroman-3-ylmethan-1-ol
Show more names
Compound Fr166872H-1-Benzopyran-3-methanol, 3,4-dihydro-
orb3170279SCHEMBL2247241UPDSWAQIQZFOLF-UHFFFAOYSA-NFr16687BDA72728SBB084398AKOS005217342SDCCGMLS-0066063.P001
Database identifiers
- CAS
76727-28-1- PubChem CID
- 2795460
- DTXSID
DTXSID40383682- Nikkaji
- J592.365D
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 147
Physicochemical properties
- Risk Statements
- 36 · 36/37/38
- Safety Statements
- 26 · 26-36/37/39
Safety & regulation
Safety data
- risk_code
- 36/37/38
- safety_code
- 26-36/37/39
Chemistry & industry
Suppliers15 total
宁波振岳医药科技有限公司19817745290 · [email protected]
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砌块化学科技（上海）有限公司021-20432219 13918097649 · [email protected]
宁波振岳医药科技有限公司0086-19817745290; 19817745290 · [email protected]
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Related reactions
6 records
Compound notes
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