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Benzene,1-(1,1-dimethylethyl)-3-e

Benzene,1-(1,1-dimethylethyl)-3-e structure

CAS No:
6630-01-9
Formula:
C13H20
Chemical Name:
Benzene,1-(1,1-dimethylethyl)-3-e
Synonyms:
3-tert-Butyl-5-ethyltoluene;1-tert-Butyl-3-ethyl-5-methylbenzene;Benzene, 1-(1,1-dimethylethyl)-3-ethyl-5-methyl-;NSC60003;ACMC-20aj6j;3-t-butyl-5-ethyltoluene;CTK6D0950;DTXSID30216511;ZINC1689942;NSC-60003

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Benzene,1-(1,1-dimethylethyl)-3-e Basic Attributes

Molecular Weight：

176.303

Exact Mass：

176.157

NSC Number：

60003

DSSTox ID：

DTXSID30216511

Characteristics

PSA：

XLogP3：

4.8

Boiling Point：

71°C/21mmHg

Flash Point：

66°C(lit.)

Safety Information

Precautionary statement(s)：

P273, P501

Hazard Statements：

H413

GHS Classification：

H413 (100%): May cause long lasting harmful effects to aquatic life [Hazardous to the aquatic environment, long-term hazard]|P273, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:176.30
XLogP3:4.8
Rotatable Bond Count:2
Exact Mass:176.156500638
Monoisotopic Mass:176.156500638
Heavy Atom Count:13
Complexity:152
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of Benzene,1-(1,1-dimethylethyl)-3-e

Basic Attributes
Characteristics
Safety Information
Computed Properties

Benzene,1-(1,1-dimethylethyl)-3-e

SDS

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