Basic information
- CAS
30779-70-5- Standard SMILES
Cc1cc(=O)c2ccc(N)cc2o1- InChIKey
PAKDFQZWVPNDSC-UHFFFAOYSA-N- Molecular formula
- C10H9NO2
- Average molar mass
- 175.18 g/mol
- Monoisotopic mass
- 175.06332853
Names & identifiers
- Preferred name
- 7-Amino-2-methylchromone
- IUPAC
- 7-amino-2-methylchromen-4-one
- English name
- 7-AMINO-2-METHYLCHROMONE 95
- Molecular formula
- C10H9NO2
- Molecular weight
- 175.18
Names & synonyms
7-Amino-2-methylchromone30779-70-5DTXSID50395110RefChem:310258DTXCID60345969625-204-27-amino-2-methyl-4H-chromen-4-one7-amino-2-methylchromen-4-one7-Amino-2-methylchromone 95MFCD04974088SCHEMBL1591847-Amino-2-methylchromone, 95%
Show more names
7-AMino-2-MethylchroMone 95%7-AMINO-2-METHYLCHROMONE 954H-1-Benzopyran-4-one, 7-amino-2-methyl-
AKOS0052586567-amino-2-methyl-chromen-4-one7-Amino-2-methyl-4H-1-benzopyran-4-oneAS-93376SY251282H54743J-018137
Database identifiers
- CAS
30779-70-5- PubChem CID
- 3691231
- DTXSID
DTXSID50395110- EC Number
- 625-204-2
- Nikkaji
- J3.194.366C
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 52.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 260
Physicochemical properties
- Melting point
- 174.5 · 174.5-179.5 °C (lit.)
- Boiling point
- 347.4 · 347.4±42.0 °C(Predicted)
- Density
- 1.275 · 1.275±0.06 g/cm3(Predicted)
- pka
- 0.99 · 0.99±0.40(Predicted)
- form
- solid
- InChI
- 1S/C10H9NO2/c1-6-4-9(12)8-3-2-7(11)5-10(8)13-6/h2-5H,11H2,1H3
- InChIKey
- PAKDFQZWVPNDSC-UHFFFAOYSA-N
- SMILES
- CC1=CC(=O)c2ccc(N)cc2O1
- UNSPSC Code
- 12352100 · 12352100
- NACRES
- 22 · NA.22
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 319 · H319
- Precautionary statements
- 305 · P305+P351+P338
- PPE
- 95 · dust mask type N95 (US), Eyeshields, Gloves
- Hazard Codes
- Xi
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
P264+P265, P280, P305+P351+P338, and P337+P317 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 1 notifications to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesEye Irrit. 2 (100%)
Safety data
- PPE
- dust mask type N95 (US), Eyeshields, Gloves
- wgk
- 3
- risk_code
- 36
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- safety_code
- 26-36
- Storage Class
- 13 - Non Combustible Solids
- Hazard statements
- H319
- Hazard Classifications
- Eye Irrit. 2
- Precautionary statements
- P305+P351+P338
Chemistry & industry
Suppliers16 total
武汉誉祥医药科技有限公司13971275651 · [email protected]
Aladdin Scientific[email protected]
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
上海瀚鸿科技股份有限公司021-54306202 13764082696 · [email protected]
上海钰康生物科技有限公司15618758386 15618758386 · [email protected]
上海珂华生物科技有限公司021-60455363 18019463053 · [email protected]
Sigma-Aldrich西格玛奥德里奇(上海)贸易有限公司021-61415566 800-8193336 · [email protected]
Henan Alfa Chemical Co., Ltd+8618339805032 · [email protected]
HANGZHOU LEAP CHEM CO., LTD.+86-571-87711850 +86-15355479329 · [email protected]
上海阿拉丁生化科技股份有限公司6206333 13167063860 · [email protected]
上海颖心实验室设备有限公司021-021-59178156 15300768757 · [email protected]
上海凌凯科技股份有限公司021-58950110 13124863828 · [email protected]
上海康恩博医药科技有限公司（科小研试剂）400-1388-521 17510465506 · [email protected]
北京珐默兹医药科技有限公司
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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