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Home> Encyclopedia > Hot Product Listed 6   > 6,7-Dimethoxy-3,4-dihydroquinazoline-4-one
13794-72-4 structure

6,7-Dimethoxy-3,4-dihydroquinazoline-4-one

Iupac Name:6,7-dimethoxy-1H-quinazolin-4-one
CAS No.:13794-72-4
EINECS(EC#): 1312995-182-4
Molecular Weight:206.201
Molecular Formula:C10H10N2O3 (isomer)
Names and Identifiers
Synonyms

10N-834 3,4-Dihydro-6,7-dimethoxy-4-oxoquinazoline 4(1h)-quinazolinone, 6,7-dimethoxy- 4(1H)-Quinazolinone,6,7-dimethoxy- (9CI) 6 pound not7-dimethoxy-1h-quinazolin-4-one 6,7-dimethoxy 4(1h)-quinazolinone 6,7-dimethoxy-1h-quinazolin-4-one 6,7-dimethoxy-3,4-dihydro-quinazolin-4-one 6,7-dimethoxy-3,4-dihydroquinazolin-4one 6,7-dimethoxy-3,4-dihydroquinazolin-4-one 6,7-dimethoxy-3,4-dihydroquinazolin4-one 6,7-dimethoxy-3,4-dihydroquinazoline-4-one 6,7-dimethoxy-3h-quinazolin-4-one 6,7-dimethoxy-3h-quinazoline-4-one 6,7-dimethoxy-3-hydroquinazolin-4-one 6,7-dimethoxy-4 (3h)-quinazolinone 6,7-dimethoxy-4(1h)-quinazolinone 6,7-dimethoxy-4-(3h) quinazolinone 6,7-dimethoxy-4-(3h)quinazolinone 6,7-dimethoxy-4-(3h)-quinazolinone 6,7-dimethoxy-4(3h)-quinazolinone 6,7-dimethoxy-4(3h)-quinazolone 6,7-dimethoxy-4-hydroxyquinazoline 6,7-dimethoxy-4-quinazolinol 6,7-dimethoxy-4-quinazolone 6,7-dimethoxyquinazolin-4(1h)-one 6,7-dimethoxyquinazolin-4(3h)-one 6,7-dimethoxy-quinazolin-4-ol 6,7-dimethoxyquinazolin-4-ol 6,7-dimethoxy-quinazolin-4-one 6,7-dimethoxyquinazolin-4-one 6,7-dimethoxyquinazolin4-one 6,7-dimethoxyquinazoline-4(3h)-one 6,7-Dimethoxyquinazoline-4-one 6.7-dimethoxy quinazolin-4-one 794d724 A807319 AB0005088 AB0014918 AB0076230 AC1LT3OC AC1Q470X AC-352 ACMC-1BRAZ ACT05866 AJ-60753 AK-25399 AKOS000117115 AKOS001039206 AM20020454 AN-3064 ANW-20364 B-3029 bb_sc-06344 BB_SC-6344 BBL029425 BC204555 BG00604094 BR-25399 BUTTPARK 47\08-40 CCG-242418 CD-541 CHEMBL1949861 CJ-13752 CS-M1056 CTK0H4585 CTK7A0033 D18551 D3816 DB-014627 DMSRMHGCZUXCMJ-UHFFFAOYSA-N DS-0458 DTXSID60363547 EN300-06937 FC0618 FT-0083548 FT-0636961 HE002637 HE209282 HMS1435C14 HMS1757K19 IDI1_012853 J-007081 JSP002283 KB-270090 KSC174K8L L841 LS40875 MAYBRIDGE3_001466 MCULE-9907272674 mfcd01570147 MOLPORT-000-003-021 MOLPORT-000-154-704 MOLPORT-002-465-236 OPREA1_495367 OR2564 PS-4400 PUBCHEM9670 QC-947 RP12006 SBB093644 SC-00973 SCHEMBL8917 SDCCGMLS-0065808.P001 STK922207 STL146420 SY007177 TL8000871 VU0512855-1 ZINC12176824 zlb0184 ZLCHEM 193

Inchi
InChI=1S/C10H10N2O3/c1-14-8-3-6-7(4-9(8)15-2)11-5-12-10(6)13/h3-5H,1-2H3,(H,11,12,13)
InChkey
DMSRMHGCZUXCMJ-UHFFFAOYSA-N
Canonical Smiles
COC1=C(C=C2C(=C1)C(=O)N=CN2)OC
Properties
Appearance
White to off-white crystalline powder
Density
1.33
Melting Point
309-311℃
Boiling Point
374.1 °C at 760 mmHg
Flash Point
374.1 °C at 760 mmHg
HS Code
29334900
Safety and Handling
Hazard Codes
Xn
Risk Statements
R20/21/22;R36/37/38
Safety Statements
S26;S37/39
HazardClass
IRRITANT
Safety

Safety Information about?6,7-Dimethoxy-3,4-dihydroquinazoline-4-one (CAS NO.13794-72-4):
Hazard Codes:HarmfulXn,Xi
Risk Statements: 20/21/22-36/37/38
R20/21/22: Harmful by inhalation, in contact with skin and if swallowed.?
R36/37/38: Irritating to eyes, respiratory system and skin.
Safety Statements: 26-37/39
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.?
S37/39: Wear suitable gloves and eye/face protection.
Hazard Note: Irritant
HazardClass: IRRITANT

MSDS

2.Hazard identification

2.1 Classification of the substance or mixture

Acute toxicity - Oral, Category 3

2.2 GHS label elements, including precautionary statements

Pictogram(s)
Signal word

Danger

Hazard statement(s)

H301 Toxic if swallowed

Precautionary statement(s)
Prevention

P264 Wash ... thoroughly after handling.

P270 Do not eat, drink or smoke when using this product.

Response

P301+P310 IF SWALLOWED: Immediately call a POISON CENTER/doctor/\u2026

P321 Specific treatment (see ... on this label).

P330 Rinse mouth.

Storage

P405 Store locked up.

Disposal

P501 Dispose of contents/container to ...

2.3 Other hazards which do not result in classification

none

Precursor and Product
Computational chemical data
  • Molecular Weight:206.201g/mol
  • Molecular Formula:C10H10N2O3
  • Compound Is Canonicalized:True
  • XLogP3-AA:0.7
  • Exact Mass:206.069
  • Monoisotopic Mass:206.069
  • Complexity:280
  • Rotatable Bond Count:2
  • Hydrogen Bond Donor Count:1
  • Hydrogen Bond Acceptor Count:3
  • Topological Polar Surface Area:59.9A^2
  • Heavy Atom Count:15
  • Defined Atom Stereocenter Count:0
  • Undefined Atom Stereocenter Count:0
  • Defined Bond Stereocenter Count:0
  • Undefined Bond Stereocenter Count:0
  • Isotope Atom Count:0
  • Covalently-Bonded Unit Count:1
  • CACTVS Substructure Key Fingerprint: AAADccBzMAAAAAAAAAAAAAAAAAAAAAAAAAAwQAAAAAAAAACBAAAAHgAQAAAADAyBmAYzxoLABACo AiVTdACCCAElIgABiIEO7MgNJjrE/JuEMapm0BlK6ce63BPOIEABAgACQABAgAIEAASAAAAAAAAA AA==
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