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2-Methylphthalazin-1-one

HCID 313378
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Basic informationOverviewNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
6091-81-2
Standard SMILES
Cn1ncc2ccccc2c1=O
InChIKey
ZXMPSTMIJQZYLV-UHFFFAOYSA-N
Molecular formula
C9H8N2O
Average molar mass
160.17 g/mol
Monoisotopic mass
160.06366288

Overview

2-methyl-1,2-dihydrophthalazin-1-one is a member of phthalazines.

Names & identifiers

Preferred name
2-Methylphthalazin-1-one
IUPAC
2-methylphthalazin-1-one
English name
2-methylphthalazin-1-one
Molecular formula
C9H8N2O
Molecular weight
160.17

Names & synonyms

2-Methylphthalazin-1-one6091-81-22-Methyl-1(2H)-phthalazinoneDTXSID40310453RefChem:263929DTXCID60261579ZXMPSTMIJQZYLV-UHFFFAOYSA-N2-Methylphthalazin-1(2H)-one2-methyl-1,2-dihydrophthalazin-1-one2-methylphthalazoneMFCD008299432-methyl-1-phthalazinone
Show more names
1(2H)-Phthalazinone, 2-methyl-
NSC227289Maybridge1_003208SCHEMBL332668SCHEMBL353252methyl-phthalazin-1-(2H)-oneorb3030159SCHEMBL1261392SCHEMBL29509350

Database identifiers

CAS
6091-81-2
PubChem CID
313378
DTXSID
DTXSID40310453
ChEBI
CHEBI:192599
Nikkaji
J1.398.171J

Properties

Computed structural propertiesFilling in

XLogP
0.6
Topological polar surface area
32.7 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
0
Heavy atoms
12
Formal charge
0
Complexity
225

Chemistry & industry

Applications

Uses2-Methyl-1(2H)-phthalazinone is a useful reagent for the preparation of trifluoromethylquinoxalinones.

Upstream & downstream products

Upstream raw materials

2-Carboxybenzaldehyde1(2H)-PhthalazinoneIodomethane

Suppliers11 total

河南利恩化工产品有限公司0371-63357898 15378766539 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
TargetMol 中国(陶术生物)400-821-0310 15002144251 · [email protected]
上海昶衍化工科技有限公司021-20242659 18930833303 · [email protected]
铜陵恒优生物科技有限公司021-50426030 13856289449;13124863828 · [email protected]
石家庄荟聚医药科技有限公司0311-0311-132 13261889099 · [email protected]
上海昂提生物科技有限公司13764913901 · [email protected]
卡斯诺化工有限公司86-13710190520 · [email protected]
Shanxi Xuanran Import and Export Trade Co., Ltd.+8617735180244 · [email protected]
常州优瑞医药科技有限公司18168818882 · [email protected]
合肥钼凯医药科技有限公司18001872185; 18001872185 · [email protected]

Additional notes

DefinitionChEBI: 2-methyl-1,2-dihydrophthalazin-1-one is a member of phthalazines.

Related reactions

2 records
New reaction record
HRID 839498 reaction equation
HRID 839498As productuspto-grants-1978_06
HRID 1378683 reaction equation
HRID 1378683As productuspto-grants-1997_09

Compound notes

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