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(3-NITROPHENYL)-PROPYNOICACID

(3-NITROPHENYL)-PROPYNOICACID structure

CAS No:
4996-15-0
Formula:
C9H5NO4
Chemical Name:
(3-NITROPHENYL)-PROPYNOICACID
Synonyms:
(3-Nitrophenyl)-propynoic acid;3-(3-nitrophenyl)prop-2-ynoic acid;3-(3-nitrophenyl)-2-propynoic acid;2-Propynoic acid,3-(3-nitrophenyl)-;(3-NITROPHENYL)-PROPYNOICACID;NSC408177;3-Nitro-phenylpropiolsaure;(3-nitrophenyl)propynoic acid;CTK4J1836;3-(3-Nitrophenyl)propiolic acid

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(3-NITROPHENYL)-PROPYNOICACID Basic Attributes

Molecular Weight：

191.14000

Exact Mass：

191.02200

NSC Number：

408177

DSSTox ID：

DTXSID80325006

HScode：

2916399090

Characteristics

PSA：

83.12000

XLogP3：

1.55410

Density：

1.47 g/cm3

Boiling Point：

393.2ºC at 760 mmHg

Flash Point：

177.6ºC

Refractive Index：

1.635

Safety Information

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

Computed Properties

Molecular Weight:191.14
XLogP3:2.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:191.02185764
Monoisotopic Mass:191.02185764
Topological Polar Surface Area:83.1
Heavy Atom Count:14
Complexity:306
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of (3-NITROPHENYL)-PROPYNOICACID

Basic Attributes
Characteristics
Safety Information
Computed Properties

(3-NITROPHENYL)-PROPYNOICACID

SDS

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