Basic information
- CAS
10527-16-9- Standard SMILES
O=Cc1c2ccccc2c(Cl)c2ccccc12- InChIKey
SHYBXXMECBHHFH-UHFFFAOYSA-N- Molecular formula
- C15H9ClO
- Average molar mass
- 240.68 g/mol
- Monoisotopic mass
- 240.03419259
Names & identifiers
- Preferred name
- 10-Chloro-9-anthraldehyde
- IUPAC
- 10-chloroanthracene-9-carbaldehyde
- English name
- 10-CHLORO-9-ANTHRALDEHYDE
- Molecular formula
- C15H9ClO
- Molecular weight
- 240.68
Names & synonyms
10-Chloro-9-anthraldehyde10-Chloroanthracene-9-carbaldehyde10527-16-9DTXSID804920210-Chloro-9-anthracenecarbaldehyde9-chloro-10-formylanthracene9-Anthraldehyde, 10-chloro-7RQ1N54G12EINECS 234-086-8DTXCID302847310Chloro9anthraldehydeRefChem:437004
Show more names
10-CHLORO-9-ANTHRALDEHYDE 97%10-Chloro-9-anthraldehyde,97%9-Anthracenecarboxaldehyde,10-chloro-N,N-diethyl-3-(2-phenoxyphenoxy)-1-propanamine hydrochloride
234-086-810-chloroanthracene-9-carboxaldehydeMFCD00001255UNII-7RQ1N54G12SCHEMBL1616239CHEMBL318765410-Chloro-9-anthraldehyde, 97%10 -chloroanthracene-9-carbaldehyde
Database identifiers
- CAS
10527-16-9- PubChem CID
- 82703
- DTXSID
DTXSID8049202- ChEMBL
CHEMBL3187654- UNII
- 7RQ1N54G12
- EC Number
- 234-086-8
- Nikkaji
- J212.460B
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 267
Experimental & physicochemical properties
PolymersOther Classes -> Polycyclic Aromatic Hydrocarbons
Physical DescriptionSolid; [Aldrich MSDS]
Physicochemical properties
- Melting point
- 215 · 215-218 °C (lit.)
- Boiling point
- 435.9 · 435.9±18.0 °C(Predicted)
- Density
- 1.327 · 1.327±0.06 g/cm3(Predicted)
- form
- solid
- InChI
- 1S/C15H9ClO/c16-15-12-7-3-1-5-10(12)14(9-17)11-6-2-4-8-13(11)15/h1-9H
- InChIKey
- SHYBXXMECBHHFH-UHFFFAOYSA-N
- SMILES
- [H]C(=O)c1c2ccccc2c(Cl)c3ccccc13
- FDA UNII
- 7 RQ1N54G12 · 7RQ1N54G12
- UNSPSC Code
- 12352100 · 12352100
- NACRES
- 22 · NA.22
- Symbol(GHS)
- 7 · GHS07
- Signal word
Safety & regulation
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazards SummaryMay cause irritation; [Aldrich MSDS] See POLYCYCLIC AROMATIC HYDROCARBONS.
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- PPE
- Eyeshields, Gloves, type N95 (US)
- wgk
- 3
- hs_code
- 2913000090
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Storage Class
- 11 - Combustible Solids
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P305+P351+P338-P330-P332+P313-P337+P313-P362-P403+P233-P405-P501
Chemistry & industry
Applications
Uses10-Chloro-9-anthraldehyde was used in the preparation of trans-1-(10-methyl-9-anthryl)-2-(4-pyridyl)-ethene, 1-(10-chloro-9-anthryl)-2-(4-pyridyl)-ethene, 1-(10-methyl-9-anthryl)-2-(4-(N-methyl)-pyridinium)ethene iodide and 1-(10-chloro-9-anthryl)-2-(4-(N-methyl)pyridinium)ethene iodide.
Suppliers24 total
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
杭州奥得科技有限公司0571-88772972-0 15057128248 · [email protected]
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]
河北枫嘉新材料科技有限公司+86-0311-87836622 +86-18712993135 · [email protected]
Aladdin Scientific[email protected]
Syntechem Co.,Ltd[email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
上海瀚鸿科技股份有限公司021-54306202 13764082696 · [email protected]
上海鑫圭生物科技有限公司15121041756 · [email protected]
Related reactions
40 records
Compound notes
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