Carbamimidothioic acid, 1,5-pentanediyl ester, dihydrobromide

Carbamimidothioic acid, 1,5-pentanediyl ester, dihydrobromide 基本信息
CAS号 6290-92-2 分子式 C7H17BrN4S2
分子量 301.27100 精确质量  300.00800
PSA  150.34000 LogP  3.96820

基本信息 展开↓

CAS号:
6290-92-2
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分子式:
C7H17BrN4S2
分子量:
301.27100
中文名称:
Carbamimidothioic acid, 1,5-pentanediyl ester, dihydrobromide
英文名称:
Carbamimidothioic acid, 1,5-pentanediyl ester, dihydrobromide
中文别名:
Carbamimidothioic acid, 1,5-pentanediyl ester, dihydrobromide
英文别名:
Carbamimidothioic acid, 1,5-pentanediyl ester, dihydrobromide;
1,5-bis-butylsulfanyl-2,4-bis-butylsulfanylmethyl-pentan-3-one;
1,5-Bis-carbamimidoylmercapto-pentan,Dihydrobromid;
1,5-bis-carbamimidoylmercapto-pentane,dihydrobromide
精确分子量/精确质量:
300.00800
极性分子表面积/PSA:
150.34000
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。
InChI:
The Key: CVOLCPYCQQUMJS-UHFFFAOYSA-N

物化性质展开↓

密度:
1.36g/cm3
沸点:
367.6ºC at 760 mmHg
闪点:
176.1ºC
折射率:
1.639

合成路线查看所有的合成路线

  • 74991-38-1

    74991-38-1

  • +

  • 17356-08-0

    aminothioamide

  • 6290-92-2

    Carbamimidothioic acid, 1,5-pentanediyl ester, dihydrobromide

  • 111-24-0

    二溴戊烷

  • +

  • 17356-08-0

    aminothioamide

  • 6290-92-2

    Carbamimidothioic acid, 1,5-pentanediyl ester, dihydrobromide

毒理性展开↓

CHEMICAL IDENTIFICATION

RTECS NUMBER :
UM9800000
CHEMICAL NAME :
Pseudourea, 2,2'-pentamethylenebis(2-thio-, dihydrobromide
CAS REGISTRY NUMBER :
6290-92-2
LAST UPDATED :
199012
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C7-H16-N4-S2.2Br-H
MOLECULAR WEIGHT :
382.23
WISWESSER LINE NOTATION :
MUYZS5SYZUM &EH 2

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
200 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
NTIS** National Technical Information Service. (Springfield, VA 22161) Formerly U.S. Clearinghouse for Scientific & Technical Information. Volume(issue)/page/year: AD277-689
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Parenteral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
90 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
THERAP Therapie. (Doin, Editeurs, 8, Place de l'Odeon, F-75006 Paris, France) V.1- 1946- Volume(issue)/page/year: 8,929,1953

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