Basic information
- CAS
874-35-1- Standard SMILES
Cc1ccc2c(c1)CCC2- InChIKey
RFXBCGVZEJEYGG-UHFFFAOYSA-N- Molecular formula
- C10H12
- Average molar mass
- 132.2 g/mol
- Monoisotopic mass
- 132.09390038
Names & identifiers
- Preferred name
- 5-Methylindan
- IUPAC
- 5-methyl-2,3-dihydro-1H-indene
- English name
- 5-Methylindane
- Molecular formula
- C10H12
- Molecular weight
- 132.2
Names & synonyms
5-METHYLINDAN874-35-15-methyl-2,3-dihydro-1H-indene2,3-Dihydro-5-methyl-1H-indene1H-Indene, 2,3-dihydro-5-methyl-Indan, 5-methyl-H86VUZ1IACIndane, 5-methylUNII-H86VUZ1IAC2,3-dihydro-5-methylindeneDTXSID50612455-methy1-2,3-dihydro-1H-indene
Show more names
5-Methylindan@50 μg/mL in Toluene
RefChem:103200DTXCID2048585RFXBCGVZEJEYGG-UHFFFAOYSA-N5-Methylindane1H-Indene,2,3-dihydro-5-methyl-MFCD049722285-METHYL INDANE5-Methylindan in isooctane
Database identifiers
- CAS
874-35-1- PubChem CID
- 13402
- DTXSID
DTXSID5061245- UNII
- H86VUZ1IAC
- Nikkaji
- J133.590A
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 0
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 117
Experimental & physicochemical properties
Kovats Retention Index
1120.99；1122.37；1122；1119；1112.54；1118.91；1123；1136.2；1127.35；1138.5；1112.2；1133；1139；1112；1126.4；1147；1152；1124
1131.1；1135.1；1137.1；1137.1；1139.9；1131.1；1135.1；1137.1；1137.1；1139.9；1135.5；1142.55；1147.03；1119；1121；1121
1480；1446.9；1447；1462
Physicochemical properties
- Melting point
- 57 · 57-59 °C
- Boiling point
- 204.15 °C · 204.15°C (rough estimate)
- Density
- 0.944 · 0.9440
- refractive index
- 1.5336 · 1.5336
- FDA UNII
- 86 VUZ1IAC · H86VUZ1IAC
- EPA Substance Registry System
- 5 · 5-Methylindan (874-35-1)
- Symbol(GHS)
- 2 · GHS02,GHS08
- Signal word
- Danger
- Hazard statements
- 304 · H304-H226
- Precautionary statements
- 501 · P501-P240-P210-P233-P243-P241-P242-P280-P370+P378-P331-P303+P361+P353-P301+P310-P403+P235-P405
Safety & regulation
Safety data
- Signal word
- Danger
- Symbol(GHS)
- GHS02,GHS08
- Hazard statements
- H304-H226
- Precautionary statements
- P501-P240-P210-P233-P243-P241-P242-P280-P370+P378-P331-P303+P361+P353-P301+P310-P403+P235-P405
Chemistry & industry
Applications
Uses5-Methylindan is a compound that is used in soy sauce flavoring.
Related reactions
2 records
Compound notes
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