7-Methylindan-4-ol

HCID 85398CAS 16400-13-8
Substructure searchFind similar structures

Basic information

Standard SMILES
Cc1ccc(O)c2c1CCC2
InChIKey
XHMLXYGITDAGDN-UHFFFAOYSA-N
Molecular formula
C10H12O
Average molar mass
148.2 g/mol
Monoisotopic mass
148.088815

Overview

7-Methylindan-4-ol is a member of indanes.

Names & identifiers

Preferred name
7-Methylindan-4-ol
IUPAC
7-methyl-2,3-dihydro-1H-inden-4-ol
English name
4-HYDROXY-7-METHYLINDANE
Molecular formula
C10H12O
Molecular weight
148.2

Names & synonyms

7-Methylindan-4-ol16400-13-8EINECS 240-450-7DTXSID30167690RefChem:546872DTXCID9090181240-450-77-methyl-2,3-dihydro-1H-inden-4-ol4-HYDROXY-7-METHYLINDANEMFCD001736757-methyl-4-indanol2,3-Dihydro-7-methyl-1H-inden-4-ol
Show more names
4-HYDROXY-7-METHYLINDANE 97%7-methyl-2,3-dihydro-1H--4-ol1H-Inden-4-ol, 2,3-dihydro-7-methyl-
7-methyl-indan-4-ol4-Hydroxy-7-methylindan73DY8D89AXorb3030581SCHEMBL1008430CHEBI:194908Fr13665SBB056316

Database identifiers

CAS
16400-13-8
PubChem CID
85398
DTXSID
DTXSID30167690
ChEBI
CHEBI:194908
UNII
73DY8D89AX
EC Number
240-450-7
Nikkaji
J286.888A

Properties

Computed structural properties

XLogP
2.8
Topological polar surface area
20.2 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
1
Rotatable bonds
0
Heavy atoms
11

Physicochemical properties

Melting point
82 °C · 82 °C
Boiling point
261.9 · 261.9±29.0 °C(Predicted)
Density
1.112 · 1.112±0.06 g/cm3(Predicted)
storage temp.
2 · 2-8°C
pka
10.7 · 10.70±0.20(Predicted)
form
Powder

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 5 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Safety data

hs_code
2905190098
risk_code
36/37/38-36-22
Signal word
Warning
Symbol(GHS)
GHS07
hazard_code
Xn
safety_code
26-36/37/39

Chemistry & industry

Applications

Uses7-Methyl-4-indanol is used as an intermediate in synthetic chemistry.

Upstream & downstream products

Suppliers24 total

上海埃逸科技有限公司13916181326 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
北京依凯诺医药技术开发有限公司18518619637 · [email protected]
陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]

Additional notes

DefinitionChEBI: 7-Methylindan-4-ol is a member of indanes.

Related reactions

3 records
New reaction record

Linked notes

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