2,2-Dimethylbenzo[d][1,3]dioxole-5-carbaldehyde

HCID 596012CAS 63124-55-0
Substructure searchFind similar structures

Basic information

Standard SMILES
CC1(C)Oc2ccc(C=O)cc2O1
InChIKey
DVERJBIPBLPJQR-UHFFFAOYSA-N
Molecular formula
C10H10O3
Average molar mass
178.18 g/mol
Monoisotopic mass
178.06299418

Names & identifiers

Preferred name
2,2-Dimethylbenzo[d][1,3]dioxole-5-carbaldehyde
IUPAC
2,2-dimethyl-1,3-benzodioxole-5-carbaldehyde
English name
1,3-Benzodioxole-5-carboxaldehyde, 2,2-dimethyl-
Molecular formula
C10H10O3
Molecular weight
178.18

Names & synonyms

63124-55-02,2-dimethylbenzo[d][1,3]dioxole-5-carbaldehyde2,2-Dimethyl-1,3-benzodioxole-5-carbaldehyde2,2-Dimethyl-benzo[1,3]dioxole-5-carbaldehydeMFCD204888971,3-Benzodioxole-5-carboxaldehyde, 2,2-dimethyl-5-Formyl-2,2-dimethyl-1,3-benzodioxoleSCHEMBL17975812,2-dimethyl-1,3-dioxaindane-5-carbaldehydeBS-45405E84689EN300-3027501
Show more names
2,2-dimethyl-1,3-Benzodioxole-5-carboxaldehyde
BB 02417872,2-dimethyl-2H-1,3-benzodioxole-5-carbaldehydeDTXSID40344334SY414459DB-3176942,2-Dimethyl-1,3-benzodioxole-5-carbaldehyde #F785059Z1486025481

Database identifiers

CAS
63124-55-0
PubChem CID
596012
DTXSID
DTXSID40344334

Properties

Computed structural properties

XLogP
1.7
Topological polar surface area
35.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
1
Heavy atoms
13

Physicochemical properties

storage temp.
2 · 2-8°C, stored under nitrogen
Appearance
Colorless to light yellow Liquid
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
302 · H302-H315-H319-H335
Precautionary statements
280 · P280-P305+P351+P338

Safety & regulation

Safety data

Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H302-H315-H319-H335
Precautionary statements
P280-P305+P351+P338

Chemistry & industry

Suppliers18 total

江苏艾康生物医药研发有限公司025-66061636 19370895928 · [email protected]
Aladdin Scientific[email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
南京药石科技股份有限公司025-86918202 4000255188 · [email protected]

Related reactions

10 records
New reaction record

Linked notes

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