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4-(4-Chloroquinazolin-2-yl)-N,N-dimethylaniline

HCID 20161174
NotesReactions
Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
79916-53-3
Standard SMILES
CN(C)c1ccc(-c2nc(Cl)c3ccccc3n2)cc1
InChIKey
ZUWQMICNQFRGOU-UHFFFAOYSA-N
Molecular formula
C16H14ClN3
Average molar mass
283.75 g/mol
Monoisotopic mass
283.0876252

Names & identifiers

Preferred name
4-(4-Chloroquinazolin-2-yl)-N,N-dimethylaniline
IUPAC
4-(4-chloroquinazolin-2-yl)-N,N-dimethylaniline
English name
4-(4-CHLOROQUINAZOLIN-2-YL)-N,N-DIMETHYLANILINE
Molecular formula
C16H14ClN3
Molecular weight
283.76

Names & synonyms

4-(4-Chloroquinazolin-2-yl)-N,N-dimethylaniline79916-53-3MFCD134647494-(4-Chloro-2-quinazolinyl)-N,N-dimethylbenzenamineBenzenamine, 4-(4-chloro-2-quinazolinyl)-N,N-dimethyl-SCHEMBL10753859ZUWQMICNQFRGOU-UHFFFAOYSA-NDTXSID401221833EDA91653BS-50970SY192091CS-0188439
Show more names
4-(4-Chloro-2-quinazolinyl)-N,N-dimethylbenzanilide4-(4-CHLOROQUINAZOLIN-2-YL)-N,N-DIMETHYLANILINE ISO 9001:2015 REACH
EN300-67831F510294-(4-Chloro-2-quinazolinyl)-N,N-dimethylaniline4-(4-chloroquinazolin-2-yl)-N,N-dimethyl-anilineF5288994-(4-CHLOROQUINAZOLIN-2-YL)-N,N-DIMETHYLANILIN4-(4-CHLOROQUINAZOLIN-2-YL)-N,N-DIMETHYLANILINE ISO 90012015 REACH

Database identifiers

CAS
79916-53-3
PubChem CID
20161174
DTXSID
DTXSID401221833
EC Number
190-771-0

Properties

Computed structural properties

XLogP
4.6
Topological polar surface area
29 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
2
Heavy atoms
20
Formal charge
0
Complexity
315

Physicochemical properties

Boiling point
364.1 · 364.1±34.0 °C(Predicted)
Density
1.259 · 1.259±0.06 g/cm3(Predicted)
pka
2.39 · 2.39±0.24(Predicted)
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
302 · H302-H315-H319-H335
Precautionary statements
261 · P261-P280-P301+P312-P302+P352-P305+P351+P338

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Safety data

Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H302-H315-H319-H335
Precautionary statements
P261-P280-P301+P312-P302+P352-P305+P351+P338

Chemistry & industry

Suppliers8 total

毕佳索(上海毕得医药科技股份有限公司)400-6005915 · [email protected]
江苏艾康生物医药研发有限公司025-58851090 19370895928 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
河南阿尔法化工有限公司0371-55013243 15324716602 · [email protected]
上海睿升化工科技有限公司15026594951 · [email protected]
上海安米克化学品有限公司微信 18019252918 18019252918 · [email protected]
苏州爱玛特生物科技有限公司0512-56316828 400-867-5858;400-867-5858 · [email protected]
Dideu Industries Group Limited+86-29-81148696 +86-15129568250 · [email protected]

Related reactions

1 records
New reaction record
HRID 717331 reaction equation
HRID 717331As productuspto-grants-2015_11

Compound notes

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