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3,4-Dehydroproline

3,4-Dehydroproline structure

CAS No:
3395-35-5
Formula:
C5H7NO2
Chemical Name:
3,4-Dehydroproline
Synonyms:
1H-Pyrrole-2-carboxylic acid,2,5-dihydro-;3-Pyrroline-2-carboxylic acid,DL-;1H-Pyrrole-2-carboxylic acid,2,5-dihydro-,(±)-;2,5-Dihydro-1H-pyrrole-2-carboxylic acid;3,4-Dehydro-DL-proline;DL-3,4-Dehydroproline;4-Pyrroline-2-carboxylic acid,DL-;3-Pyrroline-2-carboxylic acid;Proline,3,4-didehydro-;3,4-Dehydroproline;3,4-Didehydroproline;NSC 49883;3,4-Dehydro-D,L-proline;3220-74-4;28874-39-7
Categories:
Biochemical Engineering > Amino Acids and Derivatives

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Description

Off-white powder

3,4-Dehydroproline Basic Attributes

Molecular Weight：

113.11

Exact Mass：

113.11

EC Number：

222-243-3

NSC Number：

49883

HScode：

2933990090

Characteristics

PSA：

49.3

XLogP3：

0.10

Density：

1.3±0.1 g/cm3

Melting Point：

236-237 °C

Boiling Point：

279.3±40.0 °C at 760 mmHg

Flash Point：

122.7±27.3 °C

Refractive Index：

1.521

Storage Conditions：

-15°C

Safety Information

Transport codes：

NONH for all modes of transport

wgk germany：

hazard class code：

R22

safety instructions：

22-24/25

Precautionary statement(s)：

P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, P501

Hazard Statements：

H315

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.

Drug Information

MeSH Entry Terms：

3,4-dehydroproline

Computed Properties

Molecular Weight:113.11
XLogP3:-2.5
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:113.047678466
Monoisotopic Mass:113.047678466
Topological Polar Surface Area:49.3
Heavy Atom Count:8
Complexity:130
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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3,4-Dehydro-DL-proline

CAS No.: 3395-35-5

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Guide of 3,4-Dehydroproline

Description
Basic Attributes
Characteristics
Safety Information
Drug Information
Computed Properties
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3,4-Dehydroproline

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