2-Amino-5-chloroquinazoline
Basic information
- CAS
190273-70-2- Standard SMILES
Nc1ncc2c(Cl)cccc2n1- InChIKey
NUJGYORYWLHYGS-UHFFFAOYSA-N- Molecular formula
- C8H6ClN3
- Average molar mass
- 179.6 g/mol
- Monoisotopic mass
- 179.0250249
Names & identifiers
- Preferred name
- 2-Amino-5-chloroquinazoline
- IUPAC
- 5-chloroquinazolin-2-amine
- English name
- 2-Amino-5-chloroquinazoline
- Molecular formula
- C8H6ClN3
- Molecular weight
- 179.61
Names & synonyms
5-chloroquinazolin-2-amine190273-70-22-Amino-5-chloroquinazoline5-CHLORO-2-QUINAZOLINAMINE2-Quinazolinamine, 5-chloro-MFCD00974335Oprea1_2662755-Chloro-quinazolin-2-ylamineDTXSID00363167AKOS005070555CS-0063935EN300-316817
Show more names
5-Chloro-2-amino-quinazoline5-chloroquinazoline-2-ylamineSCHEMBL559893QHA27370SBB0895872-amino-5-chloroquinazoline, AldrichCPRSY031675DB-081915
Database identifiers
- CAS
190273-70-2- PubChem CID
- 1479552
- DTXSID
DTXSID00363167- EC Number
- 170-275-0
- Nikkaji
- J829.244B
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 51.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 164
Physicochemical properties
- Melting point
- 249 · 249-252°
- storage temp.
- 2 · 2-8°C
- form
- Solid
- Appearance
- Light yellow to yellow Solid
- InChI
- 1S/C8H6ClN3/c9-6-2-1-3-7-5(6)4-11-8(10)12-7/h1-4H,(H2,10,11,12)
- InChIKey
- NUJGYORYWLHYGS-UHFFFAOYSA-N
- SMILES
- Nc1ncc2c(Cl)cccc2n1
- UNSPSC Code
- 12352200 · 12352200
- NACRES
- 21 · NA.21
- Symbol(GHS)
- 6 · GHS06
- Signal word
- Danger
- Hazard statements
- 301 · H301-H311-H331
- Precautionary statements
- 261 · P261-P264-P270-P271-P280-P302+P352-P304+P340-P310-P330-P361-P403+P233-P405-P501
- WGK Germany
- 3 · WGK 3
- HazardClass
- IRRITANT
- HS Code
- 2933998090 · 2933998090
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
- wgk
- WGK 3
- hs_code
- 2933998090
- Signal word
- Danger
- Symbol(GHS)
- GHS06
- hazard_class
- IRRITANT
- Storage Class
- 6.1C - Combustible acute toxic Cat.3toxic compounds or compounds which causing chronic effects
- Hazard statements
- H301-H311-H331
- Hazard Classifications
- Acute Tox. 3 OralEye Dam. 1
- Precautionary statements
- P261-P264-P270-P271-P280-P302+P352-P304+P340-P310-P330-P361-P403+P233-P405-P501
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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