Sodium benzenesulfonate

HCID 517327CAS 515-42-4

기본 정보

표준 SMILES
O=S(=O)([O-])c1ccccc1.[Na+]
InChIKey
MZSDGDXXBZSFTG-UHFFFAOYSA-M
분자식
C6H5NaO3S
평균 분자량
180.16 g/mol
단동위원소 질량
179.9857093

개요

See also: Benzenesulfonic acid, alkyl derivs., sodium salts (annotation moved to); Sodium N-alkylbenzenesulfonate (annotation moved to).

이름 및 식별자

우선 이름
Sodium benzenesulfonate
IUPAC
sodium benzenesulfonate
영어명
Benzenesulfonic acid sodium salt
분자식
C6H7NaO3S
분자량
182.17

이름 및 동의어

Sodium benzenesulfonate515-42-4Benzenesulfonic acid, sodium saltDispersant GNSodium phenylsulfonateSodium benzene sulfonateSodium benzene monosulfonateSODIUM BENZOSULFONATEK5RM14AZHXSUPRAGIL GNBenzenesulfonic acid, sodium salt (1:1)DTXSID4060157
이름 더 보기
PhSO2NaBenzenesulfonicsodiumbenzosulfonatesodiumbenzenemonosulfatePhSO3NaBenzenesuLdispersantgnSodium sulfobenzenesodiumphenylsulfonate
NSC-146RefChem:887291DTXCID9041027208-198-2Benzenesulfonic acid sodium saltsodium;benzenesulfonateBenzenesulfonate (sodium)C6H5NaO3S

데이터베이스 식별자

CAS
515-42-4
PubChem CID
517327
DTXSID
DTXSID4060157
UNII
K5RM14AZHX
EC Number
208-198-2
Nikkaji
J6.295B

물성

구조 계산 물성

극성 표면적
65.6 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
3
회전 가능 결합 수
1
무거운 원자 수
11

실험 및 물리화학적 성질

Chemical ClassesOther Classes -> Benzenesulfonic Acid Derivatives
Color/Form · 2건

CRYSTALS

NEEDLES OR LEAFLETS FROM WATER

SolubilityVERY SOL IN HOT WATER; SLIGHTLY SOL IN HOT ALCOHOL
Physical DescriptionSolid; [HSDB] White powder; [MSDSonline]
Other Experimental PropertiesDECOMP AT 450 °C

물리화학적 성질

녹는점
450 °C · 450 °C
밀도
1.124 g/mL · 1.124 g/mL at 25 °C (lit.)
저장 조건
Inert atmosphere,Room Temperature
용해도
물에 용해
물리적 상태
결정성 분말
색상
흰색에서 황백색까지

화학적 성질

off-white crystalline powder

안전 및 규제

GHS 분류

GHS Classification · 4건

Warning

H302 (25%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, 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 96 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Regulatory Information · 3건

Chemical: Benzenesulfonic acid, sodium salt

Status: Active Update: 05-11-2015 https://echa.europa.eu/registration-dossier/-/registered-dossier/16461

Benzenesulfonic acid, sodium salt: Does not have an individual approval but may be used under an appropriate group standard

Other Safety InformationEvaluation - Chemicals that are unlikely to require further regulation to manage risks to environment
Hazards SummaryOral LD50 (mouse) = 9378 mg/kg; [RTECS] A skin irritant in guinea pig testing; No teratogenic effects in pregnant mice receiving doses up to the fatal dose of 300 mg/kg; [HSDB]
Hazard Classes and CategoriesAcute Tox. 4 (25%)

독성 정보

Non-Human Toxicity Excerpts · 5건

ACUTE EXPOSURE PRODUCED ONLY SLIGHT IRRITATION TO GUINEA PIG SKIN. /FROM TABLE/

NA ALKYLBENZENESULFONATE ADMIN IN DRINKING WATER (0.07, 0.2 & 0.6%) OR IN FEED (0.6 & 1.8%) TO MICE & RATS FOR 9 MO DECR LIVER WT, HEPATIC LEVELS OF GLUCOSE 6-PHOSPHATE DEHYDROGENASE, LACTATE DEHYDROGENASE & GLUTAMIC-PYRUVIC TRANSAMINASE.

SODIUM ALKYLBENZENESULFONATE ADMIN IN DRINKING WATER (0.07, 0.2 & 0.6%) OR IN FEED (0.6 & 1.8%) TO MICE & RATS FOR 9 MONTHS DECREASED KIDNEY LEVELS OF GLUCOSE 6-PHOSPHATASE & SODIUM, POTASSIUM ATPASE, INDICATING AN EFFECT ON KIDNEY FUNCTION.

SODIUM ALKYLBENZENESULFONATE ADMIN AT 1000 PPM IN WATER TO RATS FOR 6 WK ENHANCED THE INCREASE OF LIPIDS IN LIVER & DECREASED LEVELS OF CHOLESTEROL & PHOSPHOLIPIDS IN RED BLOOD CELLS.

For more Non-Human Toxicity Excerpts (Complete) data for SODIUM BENZOSULFONATE (9 total), please visit the HSDB record page.

안전 데이터

wgk
3
tsca
TSCA listed
rtecs
DB7350000
HS 번호
29049090
risk_code
22-36/37/38
hazard_code
Xn,Xi

화학 및 산업

약리 정보

Metabolism/MetabolitesP TESTOSTERONI H-8 UTILIZES AS SOLE CARBON SOURCE, THE SODIUM SALTS OF BENZENESULFONATE. MEDIUM MUST BE HEAVILY BUFFERED TO PERMIT EXTENSIVE GROWTH.
Absorption, Distribution and Excretion · 2건

ABSORBED SULFONATES ARE QUICKLY DISTRIBUTED THROUGH LIVING SYSTEMS, BUT ALSO READILY EXCRETED. ...SULFONATES WILL BIND TO PROTEINS & APPEAR TO TRANSLOCATE K+ /POTASSIUM IONS/ & NO3- /NITRATE IONS/ FROM CELLULAR TO INTERSTITIAL FLUID AS OCCURS...WITH SODIUM...BENZENESULFONATE.

EXCRETED AS SODIUM BENZENESULFONATE. /FROM TABLE/

용도 및 제조

Uses · 4건

Used as chemical intermediate, detergent, disinfectant, and anionic surfactant; [HSDB]

Using Disinfectants or Biocides [Category: Clean]

CHEM INT & DETERGENT

DISINFECTANT & ANIONIC SURFACTANT

General Manufacturing Information · 2건

Benzenesulfonic acid, sodium salt (1:1): ACTIVE

METHOD WAS DEVELOPED FOR REMOVING PHENOL & THIOPHENOL FROM WASTE GASES GIVEN OFF DURING MELTING OF SODIUM BENZENESULFONATE.

응용 분야 · 1건

용도Sodium benzenesulfonate has been used in Raman spectroscopic determination of molecular structural features in sulfonated polystyrene resins. It was used as electrolyte in formation of polypyrrole coatings with varying surface morphology on stainless steel. It was used in the synthesis of 1-butyl-3-propanenitrile imidazolium benzenesulfonate.

공급사50 곳

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