CAS 20074-79-7|diethyl 4-aminobenzylphosphonate

Introduction：Basic information about CAS 20074-79-7|diethyl 4-aminobenzylphosphonate, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.

Table of Contents

1. Names
2. Chemical & Physical Properties
3. Toxicological Information
CHEMICAL IDENTIFICATION
HEALTH HAZARD DATA
ACUTE TOXICITY DATA
4. Safety Information
5. Customs
6. Articles1
7. Synonyms

Common Name	diethyl 4-aminobenzylphosphonate
CAS Number	20074-79-7	Molecular Weight	243.23900
Density	1.153g/cm3	Boiling Point	383.3ºC at 760mmHg
Molecular Formula	C₁₁H₁₈NO₃P	Melting Point	90-94 °C(lit.)
MSDS	USA	Flash Point	185.6ºC

Names

Name	4-(diethoxyphosphorylmethyl)aniline
Synonym	More Synonyms

Chemical & Physical Properties

Density	1.153g/cm3
Boiling Point	383.3ºC at 760mmHg
Melting Point	90-94 °C(lit.)
Molecular Formula	C₁₁H₁₈NO₃P
Molecular Weight	243.23900
Flash Point	185.6ºC
Exact Mass	243.10200
PSA	71.36000
LogP	3.61610
Vapour Pressure	4.44E-06mmHg at 25°C
Index of Refraction	1.521
InChIKey	ZVAYUUUQOCPZCZ-UHFFFAOYSA-N
SMILES	CCOP(=O)(Cc1ccc(N)cc1)OCC

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :: SZ6480000

CHEMICAL NAME :: Phosphonic acid, p-aminobenzyl-, diethyl ester

CAS REGISTRY NUMBER :: 20074-79-7

BEILSTEIN REFERENCE NO. :: 2941613

LAST UPDATED :: 199612

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C11-H18-N-O3-P

MOLECULAR WEIGHT :: 243.27

WISWESSER LINE NOTATION :: ZR D1PO&O2&O2

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Intravenous

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 320 mg/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: CSLNX* U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. (Aberdeen Proving Ground, MD 21010) Volume(issue)/page/year: NX#05125

Safety Information

Personal Protective Equipment	Eyeshields;Gloves;type N95 (US);type P1 (EN143) respirator filter
Safety Phrases	S22-S24/25
RIDADR	NONH for all modes of transport
WGK Germany	3
RTECS	SZ6480000
HS Code	2931900090

Customs

HS Code	2931900090
Summary	2931900090. other organo-inorganic compounds. VAT:17.0%. Tax rebate rate:13.0%. Supervision conditions:AB(certificate of inspection for goods inward,certificate of inspection for goods outward). MFN tariff:6.5%. General tariff:30.0%

Articles1

Aromatic phosphonates inhibit the lysophospholipase D activity of autotaxin.

Bioorg. Med. Chem. Lett. 21 , 5098-101, (2011)

Autotaxin (ATX) is an attractive target for the anticancer therapeutics that inhibits angiogenesis, invasion and migration. ATX is an extracellular lysophospholipase D that hydrolyzes lysophosphatidyl...

Synonyms

diethyl-4-aminomethyl-phosphonate

DIETHYL 4-AMINOBENZYLPHOSPHONATE

4-aminobenzylphosphonic acid diethyl ester

Diethyl p-aminobenzylphosphonate

MFCD00007913

p-Aminobenzylphosphonic acid diethyl ester

EINECS 243-504-8

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