6-Methoxy-1-Indanone

HCID 334036CAS 13623-25-1

Basic information

Standard SMILES
COc1ccc2c(c1)C(=O)CC2
InChIKey
UJGDLLGKMWVCPT-UHFFFAOYSA-N
Molecular formula
C10H10O2
Average molar mass
162.18 g/mol
Monoisotopic mass
162.06807956

Names & identifiers

Preferred name
6-Methoxy-1-Indanone
IUPAC
6-methoxy-2,3-dihydroinden-1-one
English name
6-Methoxy-1H-indanone
Molecular formula
C10H10O2
Molecular weight
162.19

Names & synonyms

6-Methoxy-1-indanone13623-25-1DTXSID60318971RefChem:543562DTXCID50270094603-948-96-methoxy-1h-indanone6-methoxy-2,3-dihydro-1H-inden-1-one6-methoxyindan-1-one6-methoxy-2,3-dihydroinden-1-one6-methoxy-indan-1-oneMFCD00021232
Show more names
6-methoxy-1H-one6-METHOXY INDANONE6-Methoxy-1-indenone6-Methoxy-I-indanone6-Methoxyindane-1-one
1H-Inden-1-one, 2,3-dihydro-6-methoxy-2,3-dihydro-6-methoxyinden-1-one2,3-dihydro-6-methoxy-1h-inden-1-oneNSC 3382316-methoxyindanoneNSC3382316-methoxy-1-indanon6-methoxy-l-indanone

Database identifiers

CAS
13623-25-1
PubChem CID
334036
DTXSID
DTXSID60318971
EC Number
603-948-9
Nikkaji
J266.765G

Properties

Computed structural properties

XLogP
1.6
Topological polar surface area
26.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
1
Heavy atoms
12

Physicochemical properties

Melting point
105 · 105-109 °C (lit.)
Boiling point
228.88 °C · 228.88°C (rough estimate)
Density
1.0281 · 1.0281 (rough estimate)
refractive index
1.6 · 1.6000 (estimate)
storage temp.
Sealed in dry,Room Temperature
form
Fine Crystalline Powder

Safety & regulation

GHS classification

GHS Classification · 6 items

This chemical does not meet GHS hazard criteria for 25% (1 of 4) of reports.

Warning

H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral];H312 (50%): Harmful in contact with skin [Warning Acute toxicity, dermal];H315 (25%): Causes skin irritation [Warning Skin corrosion/irritation];H319 (25%): Causes serious eye irritation [Warning Serious eye damage/eye irritation];H332 (50%): Harmful if inhaled [Warning Acute toxicity, inhalation];H335 (25%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation];H400 (25%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard];H410 (25%): Very toxic to aquatic life with long lasting effects [Warning Hazardous to the aquatic environment, long-term hazard]

P261, P264, P264+P265, P270, P271, P273, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P391, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 4 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.;Reported as not meeting GHS hazard criteria per 1 of 4 reports by companies.;There are 3 notifications provided by 3 of 4 reports by companies with hazard statement code(s).;Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

Hazard information

Hazard Classes and CategoriesAcute Tox. 4 (50%);Acute Tox. 4 (50%);Skin Irrit. 2 (25%);Eye Irrit. 2A (25%);Acute Tox. 4 (50%);STOT SE 3 (25%);Aquatic Acute 1 (25%);Aquatic Chronic 1 (25%)

Safety data

PPE
Eyeshields, Gloves, type N95 (US)
wgk
3
hs_code
29145090
risk_code
20/21/22-36/37/38
Signal word
Warning
Symbol(GHS)
GHS07

Chemistry & industry

Applications · 3 items

UsesIndanone derivative as a1-adrenoceptor antagonist.

Uses6-Methoxy-1-indanone was used in the synthesis of 5-methoxyninhydrin (2,2-dihydroxy-5-methoxy-1,3-indanedione).

UsesIndanone derivative as α1-adrenoceptor antagonist.

Suppliers50 total

国药集团化学试剂有限公司86-21-63210123 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
Baoji Guokang Healthchem co.,ltd+8615604608665 15604608665 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]

Related reactions

91 records

Linked notes

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