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3-Phenyl-2-propynenitrile

3-Phenyl-2-propynenitrile structure

CAS No:
935-02-4
Formula:
C9H5N
Chemical Name:
3-Phenyl-2-propynenitrile
Synonyms:
2-Propynenitrile,3-phenyl-;Propiolonitrile,phenyl-;3-Phenyl-2-propynenitrile;Phenylcyanoacetylene;Cyanophenylacetylene;Phenylpropiolonitrile;Phenylpropynenitrile;1-Cyano-2-phenylacetylene;3-Phenylpropynenitrile;NSC 71547;1-Phenyl-2-cyanoacetylene;3-Phenylpropiolonitrile
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3-Phenyl-2-propynenitrile Basic Attributes

Molecular Weight：

127.14

Exact Mass：

127.14

NSC Number：

71547

DSSTox ID：

DTXSID90239443

HScode：

2926909090

Characteristics

PSA：

23.8

XLogP3：

2.2

Density：

1.1±0.1 g/cm3

Melting Point：

38-40 °C

Boiling Point：

73-74 °C @ Press: 3 Torr

Flash Point：

87.6±16.5 °C

Refractive Index：

1.577

Safety Information

Packing level：

Ⅲ

Transport codes：

2811

wgk germany：

hazard class code：

6.1

safety instructions：

RTECS Number：

UE0220000

Marks：

Precautionary statement(s)：

P301 + P310

Hazard Statements：

H301

GHS Classification：

|Danger|H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]|P264, P270, P301+P310, P321, P330, P405, and P501|Aggregated GHS information provided by 39 companies from 2 notifications to the ECHA C&L Inventory.

Drug Information

MeSH Entry Terms：

3-phenyl-2-propynenitrile

Computed Properties

Molecular Weight:127.14
XLogP3:2.2
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:1
Exact Mass:127.042199164
Monoisotopic Mass:127.042199164
Topological Polar Surface Area:23.8
Heavy Atom Count:10
Complexity:201
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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2-Propynenitrile, 3-phenyl- (9CI)

CAS No.: 935-02-4

Grade: Chemical Grade

Content: 95%

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2-Propynenitrile, 3-phenyl- (9CI)

CAS No.: 935-02-4

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Guide of 3-Phenyl-2-propynenitrile

Basic Attributes
Characteristics
Safety Information
Drug Information
Computed Properties
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Latest News
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3-Phenyl-2-propynenitrile

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