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3-(3,5-DIFLUOROPHENYL)PROPIONICACID

3-(3,5-DIFLUOROPHENYL)PROPIONICACID structure

CAS No:
84315-24-2
Formula:
C9H8F2O2
Chemical Name:
3-(3,5-DIFLUOROPHENYL)PROPIONICACID
Synonyms:
3-(3,5-DIFLUOROPHENYL)PROPIONIC ACID;3,5-Difluorohydrocinnamic acid, 3-(3,5-Difluorophenyl)propanoic acid;3-(3,5-difluorophenyl)propanoic acid;3,5-Difluorohydrocinnamic acid;3,5-Difluoro-benzenepropanoic acid;3-(3,5-Difluorophenyl);Benzenepropanoic acid, 3,?5-?difluoro-;BENZENEPROPANOIC ACID, 3,?5-?DIFLUORO-
Categories:
Organic Chemistry > Coordination Complexes

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3-(3,5-DIFLUOROPHENYL)PROPIONICACID Basic Attributes

Molecular Weight：

186.16

Exact Mass：

186.04923582

DSSTox ID：

DTXSID40394859

Characteristics

Density：

1.312±0.06 g/cm3

Melting Point：

59-61 °C

Boiling Point：

260.8±25.0 °C(Predicted)

PKA：

4.51±0.10

Safety Information

wgk germany：

hazard class code：

21-37/38-41

safety instructions：

26-39

Marks：

GHS Classification：

|Danger|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P310, P312, P321, P322, P330, P332+P313, P362, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:186.15
XLogP3:1.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:186.04923582
Monoisotopic Mass:186.04923582
Topological Polar Surface Area:37.3
Heavy Atom Count:13
Complexity:175
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3-(3,5-DIFLUOROPHENYL)PROPIONICACID

Basic Attributes
Characteristics
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