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N,N′-Diethylurea

N,N′-Diethylurea structure

CAS No:
623-76-7
Formula:
C5H12N2O
Chemical Name:
N,N′-Diethylurea
Synonyms:
Urea,N,N′-diethyl-;Urea,1,3-diethyl-;N,N′-Diethylurea;1,3-Diethylurea;sym-Diethylurea;NSC 429;27554-37-6
Categories:
Pharmaceutical Intermediates > Antiparkinson Agents

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N,N′-Diethylurea Basic Attributes

Molecular Weight：

116.16

Exact Mass：

116.16

BRN：

1744741

EC Number：

210-811-3

UNII：

1JWC8EN6FM

NSC Number：

429

DSSTox ID：

DTXSID90211365

HScode：

2924199090

Characteristics

PSA：

41.1

XLogP3：

0.1

Density：

0.9±0.1 g/cm3

Melting Point：

112.5 °C

Boiling Point：

263 °C

Flash Point：

121.1±18.9 °C

Refractive Index：

1.429

Water Solubility：

soluble in water.

Safety Information

Transport codes：

NONH for all modes of transport

wgk germany：

hazard class code：

11-23/24/25-36/37/38

safety instructions：

22-24/25-36/37/39-15-3/7/9

RTECS Number：

YS9354000

Marks：

F,T

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|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:116.16
XLogP3:0.1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:2
Exact Mass:116.094963011
Monoisotopic Mass:116.094963011
Topological Polar Surface Area:41.1
Heavy Atom Count:8
Complexity:64.8
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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