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Methyl 1,5-diphenyl-1h-pyrazole-3-carboxylate

HCID 790074
NotesReactions
Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
70375-79-0
Standard SMILES
COC(=O)c1cc(-c2ccccc2)n(-c2ccccc2)n1
InChIKey
XDUCEEQKAOPMAY-UHFFFAOYSA-N
Molecular formula
C17H14N2O2
Average molar mass
278.3 g/mol
Monoisotopic mass
278.10552769

Names & identifiers

Preferred name
Methyl 1,5-diphenyl-1h-pyrazole-3-carboxylate
IUPAC
methyl 1,5-diphenylpyrazole-3-carboxylate
English name
Methyl 1,5-diphenyl-1H-pyrazole-3-carboxylate
Molecular formula
C17H14N2O2
Molecular weight
278.31

Names & synonyms

methyl 1,5-diphenyl-1h-pyrazole-3-carboxylate70375-79-0methyl 1,5-diphenylpyrazole-3-carboxylateMFCD00573941CBMicro_014738SCHEMBL13239857DTXSID40355041SMSF0005272AKOS009471775AB06485CB14311FM56725
Show more names
1,5-diphenyl-3-pyrazolecarboxylic acid methyl ester1,5-diphenyl-1H-pyrazole-3-carboxylic acid methyl ester1H-Pyrazole-3-carboxylic acid, 1,5-diphenyl-, Methyl ester
AS-40841BIM-0014864.P001DB-074294CS-0210235ST50990210methyl1,5-diphenyl-1h-pyrazole-3-carboxylateF457378

Database identifiers

CAS
70375-79-0
PubChem CID
790074
DTXSID
DTXSID40355041
Nikkaji
J3.112.424G

Properties

Computed structural properties

XLogP
3.7
Topological polar surface area
44.1 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
4
Heavy atoms
21
Formal charge
0
Complexity
349

Physicochemical properties

storage temp.
Store at Room Tem.
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
302 · H302-H315-H319-H335
Precautionary statements
261 · P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P305+P351+P338-P330-P332+P313-P337+P313-P362-P403+P233-P405-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.

Safety data

Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H302-H315-H319-H335
Precautionary statements
P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P305+P351+P338-P330-P332+P313-P337+P313-P362-P403+P233-P405-P501

Chemistry & industry

Suppliers19 total

陕西缔都新材料有限公司81124267 17392282731 · [email protected]
毕佳索(上海毕得医药科技股份有限公司)400-6005915 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
Hangzhou Sage Chemical Co., Ltd.+86057186818502 13588463833 · [email protected]
长沙麓兴生物科技有限公司0731-88827538 15574813303 · [email protected]
常州科化生物科技有限公司0519-68985668 13685222090 · [email protected]
杰达维(上海)医药科技发展有限公司/J & W PharmLab021-64340559 · [email protected]
凯试(上海)科技有限公司021-50135380 · [email protected]
北京六合宁远医药科技股份有限公司010-60400365-8001 15910885229 · [email protected]
上海安米克化学品有限公司微信 18019252918 18019252918 · [email protected]
上海相辉医药科技有限公司[email protected]
江苏艾康生物医药研发有限公司025-66113011 19370895928 · [email protected]
南京美韬医药科技有限公司[email protected] · [email protected]

Related reactions

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Compound notes

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On this pageBasic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
苏州启航生物科技有限公司18662190603 · [email protected]
上海源香科生物科技有限公司13248186658 · [email protected]
上海捷世凯生物科技有限公司021-57520305 13795461237 · [email protected]
上海相辉医药科技有限公司13611835272 13611835272 · [email protected]
Shaanxi Dideu Medichem Co. Ltd+86-17392712779 · [email protected]