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(1-Phenylethylidene)hydrazine

HCID 114650
NotesReactions
Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
13466-30-3
Standard SMILES
CC(=NN)c1ccccc1
InChIKey
LEXOZHHIDPMMAC-UHFFFAOYSA-N
Molecular formula
C8H10N2
Average molar mass
134.18 g/mol
Monoisotopic mass
134.08439832

Names & identifiers

Preferred name
(1-Phenylethylidene)hydrazine
IUPAC
1-phenylethylidenehydrazine
English name
1-phenylethan-1-one hydrazone
Molecular formula
C8H10N2
Molecular weight
134.1784

Names & synonyms

(1-phenylethylidene)hydrazineSCHEMBL1005102Ethanone, 1-phenyl-, hydrazone(1-Phenyl-ethylidene)-hydrazineLEXOZHHIDPMMAC-UHFFFAOYSA-NDTXSID801306087NS00054063Acetophenone hydrazone1-PHENYLETHANONE HYDRAZONE1-phenylethan-1-one hydrazone

Database identifiers

CAS
13466-30-3
PubChem CID
114650
DTXSID
DTXSID801306087

Properties

Computed structural properties

XLogP
1.5
Topological polar surface area
38.4 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
1
Heavy atoms
10
Formal charge
0
Complexity
123

Physicochemical properties

Melting point
24 · 24-25 °C
Boiling point
148 °C · 148 °C(Press: 13 Torr)
Density
1 · 1.00±0.1 g/cm3(Predicted)
pka
3.13 · 3.13±0.70(Predicted)
Symbol(GHS)
6 · GHS06
Signal word
Danger
Hazard statements
301 · H301-H311-H331
Precautionary statements
261 · P261-P264-P270-P271-P280-P302+P352-P304+P340-P310-P330-P361-P403+P233-P405-P501

Safety & regulation

Safety data

Signal word
Danger
Symbol(GHS)
GHS06
Hazard statements
H301-H311-H331
Precautionary statements
P261-P264-P270-P271-P280-P302+P352-P304+P340-P310-P330-P361-P403+P233-P405-P501

Chemistry & industry

Upstream & downstream products

Downstream products

2'-Fluoroacetophenone

Suppliers5 total

陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]
上海拓目化工有限公司13391076197 · [email protected]
上海麦克林生化科技股份有限公司50706066 15221275939 · [email protected]
济南光尘医药科技有限公司18563726319 · [email protected]
武汉万鉴生物科技有限公司13277087647 · [email protected]

Related reactions

5 records
New reaction record
HRID 339450 reaction equation
HRID 339450As productuspto-grants-2014_11
HRID 968921 reaction equation
HRID 968921As productuspto-grants-2007_12
HRID 1184301 reaction equation
HRID 1184301As productuspto-grants-2014_03
HRID 1235331 reaction equation
HRID 1235331As productTraining data from https://doi.org/10.1039/C8SC04228D (5/10)
HRID 1391409 reaction equation
HRID 1391409As productuspto-grants-2008_03

Compound notes

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