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3,3-Dimethyl-1,5-pentanediol

3,3-Dimethyl-1,5-pentanediol structure

CAS No:
53120-74-4
Formula:
C7H16O2
Chemical Name:
3,3-Dimethyl-1,5-pentanediol
Synonyms:
3,3-Dimethylpentane-1,5-diol;3,3-Dimethyl-1,5-pentanediol;1,5-Pentanediol, 3,3-dimethyl-;3,3-dimethyl-pentane-1,5-diol;1,5-Pentanediol,3,3-dimethyl-;SCHEMBL37771;3,3-dimethyl-1,5-pentandiol;CTK1G1400;DTXSID90510466;7531AB

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3,3-Dimethyl-1,5-pentanediol Basic Attributes

Molecular Weight：

132.20074

Exact Mass：

132.11500

DSSTox ID：

DTXSID90510466

Characteristics

PSA：

40.5

XLogP3：

0.77740

Density：

0.9744 (rough estimate)

Melting Point：

44.24°C (estimate)

Boiling Point：

233.16°C (rough estimate)

Safety Information

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:132.20
XLogP3:0.8
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:4
Exact Mass:132.115029749
Monoisotopic Mass:132.115029749
Topological Polar Surface Area:40.5
Heavy Atom Count:9
Complexity:61.3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Hot Searches: sodium stearate; molybdenum disulfide; methyl ethyl ketoxime; amphotericin b yellow powder; epistane; hexane sds

Guide of 3,3-Dimethyl-1,5-pentanediol

Basic Attributes
Characteristics
Safety Information
Computed Properties

3,3-Dimethyl-1,5-pentanediol

SDS

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