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2,2-Difluoro-1-propanol

2,2-Difluoro-1-propanol structure

CAS No:
33420-52-9
Formula:
C3H6F2O
Chemical Name:
2,2-Difluoro-1-propanol
Synonyms:
1-Propanol,2,2-difluoro-;2,2-Difluoro-1-propanol;2,2-Difluoropropanol
Categories:
Pharmaceutical Intermediates > Heterocyclic Compound

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2,2-Difluoro-1-propanol Basic Attributes

Molecular Weight：

96.08

Exact Mass：

96.08

DSSTox ID：

DTXSID20539226

Characteristics

Density：

1.1855 g/cm³ @ Temp: 20 °C

Boiling Point：

101-102 °C @ Press: 760 Torr

Refractive Index：

n20/D1.349

PKA：

13.91±0.10

Safety Information

Transport codes：

UN 1987C 3 / PGIII

wgk germany：

hazard class code：

10-22-36/37/38

safety instructions：

Marks：

F,Xn

GHS Classification：

|Warning|H226 (95.35%): Flammable liquid and vapor [Warning Flammable liquids]|P210, P233, P240, P241, P242, P243, P261, P264, P270, P271, P280, P301+P312, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P370+P378, P403+P233, P403+P235, P405, and P501|Aggregated GHS information provided by 43 companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:96.08
XLogP3:0.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:96.03867113
Monoisotopic Mass:96.03867113
Topological Polar Surface Area:20.2
Heavy Atom Count:6
Complexity:44.1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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