CAS 614-21-1|2-Nitroacetophenone

Introduction：Basic information about CAS 614-21-1|2-Nitroacetophenone, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.

Table of Contents

1. Names
2. Chemical & Physical Properties
3. Safety Information
4. Customs
5. Articles1
6. Synonyms

Common Name	2-Nitroacetophenone
CAS Number	614-21-1	Molecular Weight	165.146
Density	1.2±0.1 g/cm3	Boiling Point	298.6±23.0 °C at 760 mmHg
Molecular Formula	C₈H₇NO₃	Melting Point	105-107ºC
MSDS	ChineseUSA	Flash Point	146.9±15.4 °C
Symbol	GHS07	Signal Word	Warning

Names

Name	Benzoylnitromethane
Synonym	More Synonyms

Chemical & Physical Properties

Density	1.2±0.1 g/cm3
Boiling Point	298.6±23.0 °C at 760 mmHg
Melting Point	105-107ºC
Molecular Formula	C₈H₇NO₃
Molecular Weight	165.146
Flash Point	146.9±15.4 °C
Exact Mass	165.042587
PSA	62.89000
LogP	1.68
Vapour Pressure	0.0±0.6 mmHg at 25°C
Index of Refraction	1.545
InChIKey	JTWHVBNYYWFXSI-UHFFFAOYSA-N
SMILES	O=C(C[N+](=O)[O-])c1ccccc1
Storage condition	Refrigerator (+4°C)

Safety Information

Symbol	GHS07
Signal Word	Warning
Hazard Statements	H302 + H312 + H332-H315-H319-H335
Precautionary Statements	P261-P280-P305 + P351 + P338
Personal Protective Equipment	dust mask type N95 (US);Eyeshields;Gloves
Hazard Codes	Xn: Harmful;
Risk Phrases	R20/21/22
Safety Phrases	26-37/39
RIDADR	NONH for all modes of transport
WGK Germany	3
HS Code	2914700090

Customs

HS Code	2914700090
Summary	HS: 2914700090 halogenated, sulphonated, nitrated or nitrosated derivatives of ketones and quinones, whether or not with other oxygen function Tax rebate rate:9.0% Supervision conditions:none VAT:17.0% MFN tariff:5.5% General tariff:30.0%

Articles1

Kinetics of Proton Transfer from Benzoylnitromethane and 1,2-Diphenyl-2-nitroethanone to Various Bases. Resonance, Inductive, Solvation, Steric, and Transition State Hydrogen-Bonding Effects on Intrinsic Rate Constants.

J. Org. Chem. 62(23) , 8162-8170, (1997)

The replacement of a hydrogen in nitromethane and in phenylnitromethane by the PhCO group has a strong acidifying effect, i.e., PhCOCH(2)NO(2), 5, is 5.8, 6.6, and 8.6 pK(a) units more acidic than CH(...

Synonyms

α-Nitroacetophenone

2-Nitro-1-phenylethan-1-one

MFCD00010218

2-Nitroacetophenone

WN1VR

Ethanone, 2-nitro-1-phenyl-

2-Nitro-1-phenylethanone

Benzoylnitromethane

2-Nitro-1-phenylethanon

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