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3,3-DIETHOXY-1-PROPANOL

3,3-DIETHOXY-1-PROPANOL structure

CAS No:
16777-87-0
Formula:
C7H16O3
Chemical Name:
3,3-DIETHOXY-1-PROPANOL
Synonyms:
3,3-DIETHOXY-1-PROPANOL;3,3-diethoxypropanol;3,3-Diethoxy-1-propanol 98%;3,3-Diethoxy-propan-1-ol;1-Propanol, 3,3-diethoxy-
Categories:
Pharmaceutical Intermediates > Bulk Drug Intermediates

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3,3-DIETHOXY-1-PROPANOL Basic Attributes

Molecular Weight：

148.2

Exact Mass：

148.109944368 g/mol

DSSTox ID：

DTXSID30168369

HScode：

2911000000

Characteristics

PSA：

38.69000

XLogP3：

0.76790

Density：

0.941 g/mL at 25 °C (lit.)

Boiling Point：

90-93 °C/14 mmHg (lit.)

Flash Point：

91.1ºC

Refractive Index：

n20/D 1.421(lit.)

Vapor Pressure：

0.149mmHg at 25°C

PKA：

15.05±0.10

Safety Information

wgk germany：

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.

Computed Properties

Molecular Weight:148.20
XLogP3:0.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:6
Exact Mass:148.109944368
Monoisotopic Mass:148.109944368
Topological Polar Surface Area:38.7
Heavy Atom Count:10
Complexity:59.9
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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3,3-DIETHOXY-1-PROPANOL

CAS No.: 16777-87-0

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