Cyclopropanecarbohydrazide

HCID 81396

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Basic information

CAS: 6952-93-8
Standard SMILES: NNC(=O)C1CC1
InChIKey: JFYKIEHOOZWARC-UHFFFAOYSA-N
Molecular formula: C4H8N2O
Average molar mass: 100.12 g/mol
Monoisotopic mass: 100.06366288

Names & identifiers

Preferred name: Cyclopropanecarbohydrazide
IUPAC: cyclopropanecarbohydrazide
English name: CYCLOPROPANECARBOXYLIC ACID HYDRAZIDE
Molecular formula: C4H8N2O
Molecular weight: 100.12

Names & synonyms

Cyclopropanecarbohydrazide6952-93-8EINECS 230-132-6DTXSID00219776NSC 70850RefChem:129927DTXCID50142267230-132-6Cyclopropanecarboxylic acid hydrazideMFCD00045392Cyclopropanecarboxylic acid, hydrazideCyclopropanecarboxylic hydrazide

Show more names

AKOS B014982AKOS BBS-00006496CHEMBRDG-BB 3014982ART-CHEM-BB B014982Cyclopropanecarboxylic ac...Cyclopropanecarboxylichydrazide

cyclopropane carboxylic acid hydrazideSTK008805SY046578cyclopropane carbohydrazideFT-0624285Oprea1_824763SCHEMBL3631661-(Cyclopropylcarbonyl)hydrazine

Database identifiers

CAS: 6952-93-8
PubChem CID: 81396
DTXSID: DTXSID00219776
EC Number: 230-132-6
Nikkaji: J265.992A

Properties

Computed structural properties

XLogP: -0.7
Topological polar surface area: 55.1 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 2
Rotatable bonds: 1
Heavy atoms: 7
Formal charge: 0
Complexity: 87.7

Experimental & physicochemical properties

SpringerMaterials PropertiesCrystal structure

Physicochemical properties

Melting point: 98 · 98-99℃
Boiling point: 283 · 283.0±7.0 °C(Predicted)
Density: 1.244 · 1.244±0.06 g/cm3(Predicted)
storage temp.: 2 · under inert gas (nitrogen or Argon) at 2–8 °C
pka: 13.46 · 13.46±0.20(Predicted)
Appearance: White to off-white Solid
CAS DataBase Reference: 6952 · 6952-93-8(CAS DataBase Reference)
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 315 · H315-H319
Precautionary statements: 264 · P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313
Hazard Codes: Xi
RIDADR: 2811 · UN2811
HazardClass: IRRITANT
HS Code: 2928009090 · 2928009090
Limited Quantities: 5 L · 5.0 L (1.3 gallons) (liquid) or 5.0 kg (11 lbs) (solid)
Excepted Quantities: Max Inner Pack (30g or 30ml) and Max Outer Pack (1Kg or 1L)

Safety & regulation

GHS classification

GHS Classification · 4 items

Danger

H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]

P264, P270, P301+P316, P321, P330, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 68 reports by companies from 1 notifications to the ECHA C&L Inventory.

Hazard information

Hazard Classes and CategoriesAcute Tox. 3 (100%)

Safety data

ridadr: UN2811
hs_code: 2928009090
Signal word: Warning
Symbol(GHS): GHS07
hazard_code: Xi
hazard_class: IRRITANT
Hazard statements: H315-H319
Limited Quantities: 5.0 L (1.3 gallons) (liquid) or 5.0 kg (11 lbs) (solid)
Excepted Quantities: Max Inner Pack (30g or 30ml) and Max Outer Pack (1Kg or 1L)
Precautionary statements: P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313