3,5-Di-tert-butyl-4-hydroxyhydrocinnamic acid hydrazide

HCID 64865
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Basic information

CAS
32687-77-7
Standard SMILES
CC(C)(C)c1cc(CCC(=O)NN)cc(C(C)(C)C)c1O
InChIKey
KMWIPXLIKIAZMT-UHFFFAOYSA-N
Molecular formula
C17H28N2O2
Average molar mass
292.4 g/mol
Monoisotopic mass
292.21507814

Names & identifiers

Preferred name
3,5-Di-tert-butyl-4-hydroxyhydrocinnamic acid hydrazide
IUPAC
3-(3,5-ditert-butyl-4-hydroxyphenyl)propanehydrazide
English name
3-(3,5-Di-tert-butyl-4-hydroxyphenyl)propanohydrazide
Molecular formula
C17H28N2O2
Molecular weight
292.42

Names & synonyms

3,5-Di-tert-butyl-4-hydroxyhydrocinnamic acid hydrazide3-[3,5-di(tert-butyl)-4-hydroxyphenyl]propanohydrazideLuchem aor 300EINECS 251-155-896J1F05K583-(3,5-Di-tert-butyl-4-hydroxyphenyl)propionohydrazideBenzenepropanoic acid, 3,5-bis(1,1-dimethylethyl)-4-hydroxy-, hydrazide3,5-Di-tert-butyl-4-hydroxyhydrocinnamic acid, hydrazide3-(3,5-Di-tert-butyl-4-hydroxyphenyl)propionic acid hydrazideHydrocinnamic acid, 3,5-di-tert-butyl-4-hydroxy-, hydrazide3-(3,5-DI(TERT-BUTYL)-4-HYDROXYPHENYL)PROPANOHYDRAZIDE3-(3,5-DI-TERT-BUTYL-4-HYDROXYPHENYL)PROPIONYLHYDRAZINE
Show more names
3-(3,5-ditert-butyl-4-hydroxyphenyl)propanehydrazide3-(3,5-ditert-butyl-4-hydroxy-phenyl)propanehydrazide3-(3,5-Ditertbutyl-4-hydroxyphenyl)propionyl hydrazineb-(3,5-Di-tert-butyl-4-hydroxyphenyl)propionic acid hydrazide3,5-Bis(1,1-dimethylethyl)-4-hydroxybenzenepropionic acid hydrazideBENZENEPROPANOICACID,3,5-BIS(1,1-DIMETHYLETHYL)-4-HYDROXY-,HYDRAZIDE3-(3,5-DI-TERT-BUTYL-4-HYDROXYPHENYL)PROPIONYL HYDRAZINE, 98.0%MIN (HPLC)
.BETA.-(3,5-DI-TERT-BUTYL-4-HYDROXYPHENYL)PROPIONYL HYDRAZIDE3,5-bis(1,1-dimethylethyl)-4-hydroxybenzenepropanoic acid hydrazideN-(.BETA.-(3,5-DI-TERT-BUTYL-4-HYDROXYPHENYL)PROPIONYL)HYDRAZINERefChem:486584BETA-(3,5-DI-TERT-BUTYL-4-HYDROXYPHENYL)PROPIONYL HYDRAZIDEN-(BETA-(3,5-DI-TERT-BUTYL-4-HYDROXYPHENYL)PROPIONYL)HYDRAZINE32687-77-73-(3,5-di-tert-butyl-4-hydroxyphenyl)propanehydrazide

Database identifiers

CAS
32687-77-7
PubChem CID
64865
DTXSID
DTXSID1027978
ChEMBL
CHEMBL1586239
UNII
96J1F05K58
EC Number
251-155-8
Nikkaji
J319.417E

Properties

Computed structural properties

XLogP
3.7
Topological polar surface area
75.4 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
3
Rotatable bonds
5
Heavy atoms
21

Experimental & physicochemical properties

Solubility26.6 [ug/mL] (The mean of the results at pH 7.4)
Collision Cross Section174.5 Ų [M-H]- [CCS Type: DT; Buffer gas: N2; Ionization: ESI-; Dataset: TOXCAST; Source Identifier: DTXSID1027978]

Physicochemical properties

Melting point
147 · 147-150°C
FDA UNII
96 J1F05K58 · 96J1F05K58
EPA Substance Registry System
3 · 3,5-Di-tert-butyl-4-hydroxyhydrocinnamic acid hydrazide (32687-77-7)
Hazard Codes
T
Risk Statements
25 · 25
Safety Statements
45 · 45

Safety & regulation

GHS classification

GHS Classification · 3 items

This chemical does not meet GHS hazard criteria for 99% (104 of 105) of all reports.

Not Classified

Aggregated GHS information provided per 105 reports by companies from 2 notifications to the ECHA C&L Inventory.

Hazard information

Hazard Classes and CategoriesNot Classified

Safety data

tsca
TSCA listed
risk_code
25
hazard_code
T
safety_code
45
hazard_class
IRRITANT

Chemistry & industry

Uses & manufacturing

General Manufacturing InformationBenzenepropanoic acid, 3,5-bis(1,1-dimethylethyl)-4-hydroxy-, hydrazide: ACTIVE

Upstream & downstream products

Downstream products

Suppliers15 total

陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
山东利腾生物科技有限公司+86-18663721413 +86-15552573001 · [email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
烟台正信新材料科技有限公司13854547682 13854547682 · [email protected]

Related reactions

32 records
New reaction record

Compound notes

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