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2-Methyl-2-(phenylmethyl)-1,3-propanediol

2-Methyl-2-(phenylmethyl)-1,3-propanediol structure

CAS No:
2109-99-1
Formula:
C11H16O2
Chemical Name:
2-Methyl-2-(phenylmethyl)-1,3-propanediol
Synonyms:
1,3-Propanediol,2-methyl-2-(phenylmethyl)-;1,3-Propanediol,2-benzyl-2-methyl-;2-Methyl-2-(phenylmethyl)-1,3-propanediol;NSC 172549;2-Benzyl-2-methyl-1,3-propanediol;2-Benzyl-2-methylpropane-1,3-diol

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2-Methyl-2-(phenylmethyl)-1,3-propanediol Basic Attributes

Molecular Weight：

180.24 g/mol

Exact Mass：

180.24

NSC Number：

172549

DSSTox ID：

DTXSID10305896

Characteristics

PSA：

40.5 Å²

Melting Point：

73-74 °C

Boiling Point：

150-153 °C @ Press: 1.5 Torr

Safety Information

GHS Classification：

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P264, P270, P280, P301+P312, P305+P351+P338, P330, P337+P313, 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:180.24
XLogP3:1.5
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:4
Exact Mass:180.115029749
Monoisotopic Mass:180.115029749
Topological Polar Surface Area:40.5
Heavy Atom Count:13
Complexity:135
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-Methyl-2-(phenylmethyl)-1,3-propanediol

Basic Attributes
Characteristics
Safety Information
Computed Properties

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