3-Nitrobenzamide

HCID 12576CAS 645-09-0

기본 정보

표준 SMILES
NC(=O)c1cccc([N+](=O)[O-])c1
InChIKey
KWAYEPXDGHYGRW-UHFFFAOYSA-N
분자식
C7H6N2O3
평균 분자량
166.13 g/mol
단동위원소 질량
166.03784205

개요

M-nitrobenzamide is a yellow powder. (NTP, 1992)

이름 및 식별자

우선 이름
3-Nitrobenzamide
IUPAC
3-nitrobenzamide
영어명
3-Nitrobenzamide
분자식
C7H6N2O3
분자량
166.13

이름 및 동의어

3-NitrobenzamideM-NITROBENZAMIDEBenzamide, 3-nitro-DTXSID5025732EINECS 211-431-0NSC 37327BRN 0777185DTXCID605732RefChem:950183-NITROBENZOIC ACID, AMIDE211-431-04-09-00-01061 (Beilstein Handbook Reference)
이름 더 보기
3-nitro-benzamidN-nitrobenzamidem-nitro-benzamid3-Nitrobenzamide>Benzamide, m-nitro-3-Nitrobenzamide,98%
KWAYEPXDGHYGRW-UHFFFAOYSA-N645-09-0Benzamide, m-nitro-MFCD000079843-Nitro-benzamideKMU7X7KT5TCHEMBL338567NSC-37327

데이터베이스 식별자

CAS
645-09-0
PubChem CID
12576
DTXSID
DTXSID5025732
ChEMBL
CHEMBL338567
UNII
KMU7X7KT5T
EC Number
211-431-0
Nikkaji
J96.213I

물성

구조 계산 물성

XLogP
0.8
극성 표면적
88.9 Ų
수소 결합 공여자 수
1
수소 결합 수용자 수
3
회전 가능 결합 수
1
무거운 원자 수
12

실험 및 물리화학적 성질

SpringerMaterials PropertiesDiamagnetic susceptibility
LogP0.77
Solubilityless than 0.1 mg/mL at 64 °F (NTP, 1992)
Boiling Point590 to 599 °F at 760 mmHg (NTP, 1992)
Melting Point288.9 °F (NTP, 1992)
Physical DescriptionM-nitrobenzamide is a yellow powder. (NTP, 1992)

물리화학적 성질

녹는점
140 · 140-143 °C (lit.)
끓는 점
312.55 °C · 312.55°C
밀도
1.4994 · 1.4994 (rough estimate)
굴절률
1.588 · 1.5880 (estimate)
저장 조건
Sealed in dry,Room Temperature
물리적 상태
결정질 분말 또는 결정

화학적 성질

yellow powder

안전 및 규제

GHS 분류

GHS Classification · 4건

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 6 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Fire HazardsFlash point data for this compound are not available, however, it is probably combustible. (NTP, 1992)
Reactive GroupAmides and Imides
Reactivity Profile · 1건

A nitrated amide. Organic amides/imides react with azo and diazo compounds to generate toxic gases. Flammable gases are formed by the reaction of organic amides/imides with strong reducing agents. Amides are very weak bases (weaker than water). Imides are less basic yet and in fact react with strong bases to form salts. That is, they can react as acids. Mixing amides with dehydrating agents such as P2O5 or SOCl2 generates the corresponding nitrile. The combustion of these compounds generates mixed oxides of nitrogen (NOx).

Air and Water ReactionsInsoluble in water.
Hazard Classes and CategoriesAcute Tox. 4 (100%)

안전 및 보호

Fire FightingFires involving this compound can be controlled with dry chemical, carbon dioxide or Halon extinguishers. (NTP, 1992)
First Aid · 1건

EYES: First check the victim for contact lenses and remove if present. Flush victim's eyes with water or normal saline solution for 20 to 30 minutes while simultaneously calling a hospital or poison control center. Do not put any ointments, oils, or medication in the victim's eyes without specific instructions from a physician. IMMEDIATELY transport the victim after flushing eyes to a hospital even if no symptoms (such as redness or irritation) develop.

Nonfire Spill Response · 1건

SMALL SPILLS AND LEAKAGE: You should dampen the solid spill material with acetone, then transfer the dampened material to a suitable container. Use absorbent paper dampened with acetone to pick up any remaining material. Seal your contaminated clothing and the adsorbent paper in a vapor-tight plastic bag for eventual disposal. Solvent wash all contaminated surfaces with acetone followed by washing with a strong soap and water solution. Do not reenter the contaminate area until the Safety Officer (or other responsible person) has verified that the area has been properly cleaned.

Personal Protective Equipment (PPE) · 1건

RECOMMENDED RESPIRATOR: Where the neat test chemical is weighed and diluted, wear a NIOSH-approved half face respirator equipped with an organic vapor/acid gas cartridge (specific for organic vapors, HCl, acid gas and SO2) with a dust/mist filter. (NTP, 1992)

안전 데이터

wgk
3
tsca
TSCA listed
rtecs
CV5601250
HS 번호
29242990
risk_code
22-36/37/38
safety_code
24/25-36/37-26

화학 및 산업

용도 및 제조

General Manufacturing InformationBenzamide, 3-nitro-: INACTIVE

응용 분야

일반 설명Yellow powder.

상·하류 제품 정보

공급사50 곳

格林斯柏生物科技(江苏)有限公司0523-87726088 13705266400 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
南通润丰石油化工有限公司66017690 19952660367 · [email protected]
毕佳索(上海毕得医药科技股份有限公司)400-6005915 · [email protected]

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20건

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