酸性橙3

酸性橙3 基本信息
CAS号 6373-74-6 分子式 C18H13N4NaO7S
分子量 452.37300 精确质量  452.04000
PSA  181.28000 LogP  6.16750

基本信息 展开↓

CAS号:
6373-74-6
3D弹球模型:
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分子式:
C18H13N4NaO7S
分子量:
452.37300
中文名称:
酸性橙3
英文名称:
Acid Orange 3
中文别名:
酸性橙3;
酸性橙 ER;
2-苯胺基-5-[(2,4-二硝基苯基)氨基]苯磺酸钠;
酸性橙 3
英文别名:
Acid Orange 3;
Anadurm Orange A-E;
Vicoacid Orange 3.;
Acid Orange R;
Dyacid Yellow A;
FASTYELLOWLIGHT;
Yellow 3R;
Multacid Yellow 3R;
Covalene Orange E
精确分子量/精确质量:
452.04000
极性分子表面积/PSA:
181.28000
油水分配系数/LogP:

LogP值指的是某物质在正辛醇/水两相体系中的分配系数的对数值,反映了物质在油水两相中的分配情况。其中、LogP值越大,说明该物质越亲油;反之,LogP值越小,则说明该物质越亲水。
EINECS:
228-921-5
InChI:
InChI=1/C18H14N4O7S.Na/c23-21(24)14-7-9-15(17(11-14)22(25)26)20-13-6-8-16(18(10-13)30(27,28)29)19-12-4-2-1-3-5-12;/h1-11,19-20H,(H,27,28,29);/q;+1/p-1

物化性质展开↓

外观与性状:
棕色至暗棕色微结晶粉末
熔点:
204ºC

安全信息展开↓

海关代码:
3204120000

毒理性展开↓

CHEMICAL IDENTIFICATION

RTECS NUMBER :
DB5042500
CHEMICAL NAME :
Benzenesulfonic acid, 2-anilino-5-(2,4-dinitroanilino)-, monosodium salt
CAS REGISTRY NUMBER :
6373-74-6
LAST UPDATED :
199710
DATA ITEMS CITED :
12
MOLECULAR FORMULA :
C18-H13-N4-O7-S.Na
MOLECULAR WEIGHT :
452.40
WISWESSER LINE NOTATION :
WSQR BMR& DMR BNW DNW &-NA-

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
97500 mg/kg/13W-I
TOXIC EFFECTS :
Kidney, Ureter, Bladder - other changes Related to Chronic Data - death
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
65 gm/kg/13W-I
TOXIC EFFECTS :
Kidney, Ureter, Bladder - other changes
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
386 gm/kg/2Y-I
TOXIC EFFECTS :
Tumorigenic - Carcinogenic by RTECS criteria Kidney, Ureter, Bladder - Kidney tumors

MUTATION DATA

TYPE OF TEST :
Mutation in microorganisms
TEST SYSTEM :
Bacteria - Salmonella typhimurium
DOSE/DURATION :
100 ug/plate
REFERENCE :
EMMUEG Environmental and Molecular Mutagenesis. (Alan R. Liss, Inc., 41 E. 11th St., New York, NY 10003) V.10- 1987- Volume(issue)/page/year: 11(Suppl 12),1,1988 *** REVIEWS *** IARC Cancer Review:Animal Limited Evidence IMEMDT IARC Monographs on the Evaluation of Carcinogenic Risk of Chemicals to Man. (WHO Publications Centre USA, 49 Sheridan Ave., Albany, NY 12210) V.1- 1972- Volume(issue)/page/year: 57,121,1993 IARC Cancer Review:Human Inadequate Evidence IMEMDT IARC Monographs on the Evaluation of Carcinogenic Risk of Chemicals to Man. (WHO Publications Centre USA, 49 Sheridan Ave., Albany, NY 12210) V.1- 1972- Volume(issue)/page/year: 57,121,1993 IARC Cancer Review:Group 3 IMEMDT IARC Monographs on the Evaluation of Carcinogenic Risk of Chemicals to Man. (WHO Publications Centre USA, 49 Sheridan Ave., Albany, NY 12210) V.1- 1972- Volume(issue)/page/year: 57,121,1993 *** NIOSH STANDARDS DEVELOPMENT AND SURVEILLANCE DATA *** NIOSH OCCUPATIONAL EXPOSURE SURVEY DATA : NOES - National Occupational Exposure Survey (1983) NOES Hazard Code - X9543 No. of Facilities: 2258 (estimated) No. of Industries: 1 No. of Occupations: 1 No. of Employees: 22238 (estimated) No. of Female Employees: 14728 (estimated)
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