Basic information
- CAS
1955-61-9- Standard SMILES
Cc1ccc2nc(N)nc(N)c2c1- InChIKey
LSNYLNXZYSKOGM-UHFFFAOYSA-N- Molecular formula
- C9H10N4
- Average molar mass
- 174.2 g/mol
- Monoisotopic mass
- 174.09054634
Names & identifiers
- Preferred name
- 2,4-Diamino-6-methylquinazoline
- IUPAC
- 6-methylquinazoline-2,4-diamine
- English name
- 6-Methyl-quinazoline-2,4-diamine
- Molecular formula
- C9H10N4
- Molecular weight
- 174.2
Names & synonyms
2,4-Diamino-6-methylquinazoline1955-61-92,4-Quinazolinediamine, 6-methyl-V7XWD44K88NSC 403380NSC-403380UNII-V7XWD44K886-Methyl-2,4-quinazolinediamineDTXSID40173222QUINAZOLINE, 2,4-DIAMINO-6-METHYL-RefChem:197369DTXCID9095713
Show more names
6-methylquinazoline-2,4-diamine6-Methyl-quinazoline-2,4-diamineNSC403380CHEMBL268456SCHEMBL6679745BDBM50404686AKOS006295343DB-181625
Database identifiers
- CAS
1955-61-9- PubChem CID
- 345652
- DTXSID
DTXSID40173222- ChEMBL
CHEMBL268456- UNII
- V7XWD44K88
- EC Number
- 674-093-7
- Nikkaji
- J477.999A
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 77.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 0
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 184
Physicochemical properties
- Melting point
- 258 · 258-259.5 °C
- Boiling point
- 461.2 · 461.2±37.0 °C(Predicted)
- Density
- 1.331 · 1.331±0.06 g/cm3(Predicted)
- pka
- 7.84 · 7.84±0.30(Predicted)
- FDA UNII
- 7 XWD44K88 · V7XWD44K88
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 312 · H312-H335-H319-H302-H315-H332
- Precautionary statements
- 264 · P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362-P264-P270-P301+P312-P330-P501-P261-P271-P304+P340-P312-P280-P302+P352-P312-P322-P363-P501
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
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, P317, 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
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H312-H335-H319-H302-H315-H332
- Precautionary statements
- P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362-P264-P270-P301+P312-P330-P501-P261-P271-P304+P340-P312-P280-P302+P352-P312-P322-P363-P501
Chemistry & industry
Suppliers5 total
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
苏州施亚生物科技有限公司0512-0512-52358471 17715136450 · [email protected]
四川铂友生物科技有限公司（原四川佰朋）028-65791793 18140026355 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…