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N-[bis(aziridin-1-yl)phosphoryl]-3,5-dibromobenzamide

N-[bis(aziridin-1-yl)phosphoryl]-3,5-dibromobenzamide structure

CAS No:
730-90-5
Formula:
C11H12Br2N3O2P
Chemical Name:
N-[bis(aziridin-1-yl)phosphoryl]-3,5-dibromobenzamide
Synonyms:
Benzamide, N-(bis(1-aziridinyl)phosphinyl)-3,5-dibromo-;N-(Bis(1-aziridinyl)phosphinyl)-3,5-dibromobenzamide;730-90-5;BRN 1323279;N-[Bis(1-aziridinyl)phosphinyl]-3,5-dibromobenzamide;DTXSID50223282

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N-[bis(aziridin-1-yl)phosphoryl]-3,5-dibromobenzamide Basic Attributes

Molecular Weight：

409.01 g/mol

Exact Mass：

408.90134 g/mol

DSSTox ID：

DTXSID50223282

Characteristics

PSA：

52.2 Å²

XLogP3：

2.9474

Melting Point：

175 °C (acetone)

Toxicity

Name	Type of Test	Exposure Route	Species Observed	Dose/Duration	Toxic Effects	Reference
ACUTE TOXICITY DATA	LD50 - Lethal dose, 50 percent kill	Unreported	Rodent - rat	100 mg/kg	Tumorigenic--active as anti-cancer agent	Pharmaceutical Chemistry Journal (English Translation). Translation of KHFZAN. (Plenum Pub. Corp., 233 Spring St., New York, NY 10013) No.1- 1967- Volume(issue)/page/year: 16,626,1982

Computed Properties

Molecular Weight:409.01
XLogP3:2.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:408.90134
Monoisotopic Mass:406.90339
Topological Polar Surface Area:52.2
Heavy Atom Count:19
Complexity:402
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Hot Searches: dinitrogen tetroxide; no2 molar mass; nitrous acid formula; jxl-069; isopropyl ether; quinone

Guide of N-[bis(aziridin-1-yl)phosphoryl]-3,5-dibromobenzamide

Basic Attributes
Characteristics
Toxicity
Computed Properties

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