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2-Propylheptanol

2-Propylheptanol structure

CAS No:
10042-59-8
Formula:
C10H22O
Chemical Name:
2-Propylheptanol
Synonyms:
1-Heptanol,2-propyl-;2-Propyl-1-heptanol;2-Propylheptanol;2-Propylheptyl alcohol
Categories:
Organic Chemistry > Coordination Complexes

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Description

Liquid

2-Propylheptanol Basic Attributes

Molecular Weight：

158.28100

Exact Mass：

158.28

EC Number：

233-126-1

DSSTox ID：

DTXSID9029302

Characteristics

PSA：

20.23000

XLogP3：

2.97530

Appearance：

Light yellow oil

Density：

0.826g/cm3

Boiling Point：

112-115 °C @ Press: 14 Torr

Flash Point：

87.1ºC

Refractive Index：

1.434

Vapor Pressure：

0.0283mmHg at 25°C

Safety Information

RTECS Number：

MJ4800000

GHS Classification：

|Danger|H302 (26.19%): Harmful if swallowed [Warning Acute toxicity, oral]|P264, P270, P273, P280, P301+P312, P302+P352, P305+P351+P338, P310, P321, P330, P332+P313, P337+P313, P362, and P501|Aggregated GHS information provided by 205 companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

2-Propylheptanol Use and Manufacturing

Uses

Intermediates

Manufacturing Info：

All other basic organic chemical manufacturing|1-Heptanol, 2-propyl-: ACTIVE

Computed Properties

Molecular Weight:158.28
XLogP3:3.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:7
Exact Mass:158.167065321
Monoisotopic Mass:158.167065321
Topological Polar Surface Area:20.2
Heavy Atom Count:11
Complexity:71.3
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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CAS No.: 10042-59-8

Content: 99.00%

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CAS No.: 10042-59-8

Grade: Industrial Grade

Content: 99%

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