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2-Phenylhydrazinecarboxaldehyde

HCID 12154
NotesReactions
Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
622-84-4
Standard SMILES
O=CNNc1ccccc1
InChIKey
QIWOKEQEGOOGGH-UHFFFAOYSA-N
Molecular formula
C7H8N2O
Average molar mass
136.15 g/mol
Monoisotopic mass
136.06366288

Names & identifiers

Preferred name
2-Phenylhydrazinecarboxaldehyde
IUPAC
N-anilinoformamide
English name
1-Formyl-2-phenylhydrazine
Molecular formula
C7H8N2O
Molecular weight
136.15

Names & synonyms

622-84-4Hydrazinecarboxaldehyde, 2-phenyl-Formic acid, 2-phenylhydrazideN'-Formyl-N-phenylhydrazine1-Phenyl-2-formylhydrazineVE4U62H7IL2-PhenylhydrazinecarboxaldehydeNSC-122444NSC-406126RefChem:10641721-Formyl-2-phenylhydrazineN'-phenylformohydrazide
Show more names
NSC 406126AURORA KA-348TIMTEC-BB SBB008261N-(anilino)formamideN'-PhenylformhydrazideN'-Phenylformic hydrazide
N-anilinoformamideN'-phenylcarbohydrazideHYDRAZINE, 1-FORMYL-2-PHENYL-2-Formyl-1-phenylhydrazineN-FormylfenylhydrazinFenylhydrazid kyseliny mravenciMFCD00043517NSC 122444

Database identifiers

CAS
622-84-4
PubChem CID
12154
DTXSID
DTXSID50211245
UNII
VE4U62H7IL
EC Number
106-055-8
Nikkaji
J36.946B

Properties

Computed structural properties

XLogP
1.4
Topological polar surface area
41.1 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
2
Rotatable bonds
2
Heavy atoms
10
Formal charge
0
Complexity
99.8

Physicochemical properties

Melting point
142 · 142-143℃
Boiling point
226.6 ℃ · 226.6℃
Density
1.183 · 1.183
Flash point
103.1 ℃ · 103.1℃
storage temp.
2 · 2-8°C
pka
12.94 · 12.94±0.23(Predicted)
Appearance
Light brown to brown Solid
InChI
InChI=1S/C7H8N2O/c10-6-8-9-7-4-2-1-3-5-7/h1-6,9H,(H,8,10)
InChIKey
QIWOKEQEGOOGGH-UHFFFAOYSA-N
SMILES
N(C=O)NC1=CC=CC=C1
EWG's Food Scores
1 · 1
FDA UNII
4 U62H7IL · VE4U62H7IL
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
317 · H317-H319
Precautionary statements
280 · P280-P305+P351+P338

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
H317-H319
Precautionary statements
P280-P305+P351+P338

Chemistry & industry

Suppliers17 total

南京世洲生物科技有限公司025-85560043 15850508050 · [email protected]
杭州品高化工有限公司0571-87658025 · [email protected]
上海亚兴生物医药科技有限公司021-58956006,021-58950017 15800617331 · [email protected]
梯希爱(上海)化工贸易有限公司021-61109150 · [email protected]
阳谷荣科商贸有限公司15863541132 · [email protected]
陕西缔都医药化工有限公司+86-29-87569262 +86-15003564040 · [email protected]
上海源叶生物科技有限公司18916372613 · [email protected]
济南荣科药业有限公司18615606162 · [email protected]
Shaanxi Dideu New Materials Co. Ltd18192503167 · [email protected]
湖北诺纳科技有限公司027-59209883 17386138556 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 13913916777 · [email protected]
陕西缔都医药化工有限公司029-029-029-81148696 18161915376 · [email protected]
山东煜昌药业有限公司531-87153728 13805401165 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]

Related reactions

6 records
New reaction record
HRID 209860 reaction equation
HRID 209860As productTraining data from https://doi.org/10.1039/C8SC04228D (6/10)
HRID 559143 reaction equation
HRID 559143As productuspto-grants-2011_11
HRID 674172 reaction equation
HRID 674172As productTraining data from https://doi.org/10.1039/C8SC04228D (3/10)
HRID 938117 reaction equation
HRID 938117As reactantValidation data from https://doi.org/10.1039/C8SC04228D
HRID 1952765 reaction equation
HRID 1952765As productuspto-grants-2000_09
HRID 1952766 reaction equation
HRID 1952766As reactantuspto-grants-2000_09

Compound notes

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On this pageBasic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
HANGZHOU LEAP CHEM CO., LTD.+86-571-87711850 +8619957148339 · [email protected]
湖北诺纳科技有限公司027-59209883 17386169806 · [email protected]
湖北云镁科技有限公司027-59206672 18995657604 · [email protected]