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Acetylcysteamine

Acetylcysteamine structure

CAS No:
1190-73-4
Formula:
C4H9NOS
Chemical Name:
Acetylcysteamine
Synonyms:
Acetamide,N-(2-mercaptoethyl)-;N-(2-Mercaptoethyl)acetamide;N-Acetylcysteamine;Acetylcysteamine;2-Acetamidoethanethiol;N-Acetylmercaptoethylamine;N-Acetyl-β-mercaptoethylamine;N-(β-Mercaptoethyl)acetamide;NSC 38835;N-Acetyl-2-mercaptoethylamine;N-(2-Sulfanylethyl)acetamide
Categories:
Organic Chemistry > Amides

Description

ChEBI: A member of the class of acetamides that is the N-acetyl-deriavtive of cysteamine.

N-acetylcysteamine is a member of the class of acetamides that is the N-acetyl-deriavtive of cysteamine. It has a role as a metabolite. It derives from a cysteamine.

Acetylcysteamine Basic Attributes

Molecular Weight：

119.19

Exact Mass：

119.19

NSC Number：

38835

DSSTox ID：

DTXSID90152289

HScode：

2930909090

Characteristics

PSA：

67.90000

XLogP3：

0.44320

Density：

1.121 g/mL at 25 °C(lit.)

Melting Point：

86 °C (approx)

Boiling Point：

138-140 °C @ Press: 7 Torr

Flash Point：

>230 °F

Refractive Index：

n 20/D 1.511(lit.)

Safety Information

Transport codes：

NONH for all modes of transport

wgk germany：

hazard class code：

R36/37/38

safety instructions：

26-37/39

RTECS Number：

AC4620000

Marks：

Precautionary statement(s)：

P261-P305 + P351 + P338

Hazard Statements：

H315-H319-H335

GHS Classification：

|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 39 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Drug Information

MeSH Entry Terms：

2-acetamidoethanethiol

Computed Properties

Molecular Weight:119.19
XLogP3:-0.2
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:119.04048508
Monoisotopic Mass:119.04048508
Topological Polar Surface Area:30.1
Heavy Atom Count:7
Complexity:64.7
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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