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[(cyclopropylmethyl)thio]aceticacid

[(cyclopropylmethyl)thio]aceticacid structure

CAS No:
959241-50-0
Formula:
C6H10O2S
Chemical Name:
[(cyclopropylmethyl)thio]aceticacid
Synonyms:
Albb-004308;[(cyclopropylmethyl)thio]acetic acid(SALTDATA: FREE);[(cyclopropylmethyl)thio]acetic acid;2-(cyclopropylmethylsulfanyl)acetic acid;Acetic acid, 2-[(cyclopropylmethyl)thio]-

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[(cyclopropylmethyl)thio]aceticacid Basic Attributes

Molecular Weight：

146.21

Exact Mass：

146.04015073

DSSTox ID：

DTXSID90649220

Characteristics

Density：

1.261±0.06 g/cm3

Boiling Point：

270.8±23.0 °C(Predicted)

PKA：

3.84±0.10

Safety Information

Hazard category：

IRRITANT

Computed Properties

Molecular Weight:146.21
XLogP3:1.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:146.04015073
Monoisotopic Mass:146.04015073
Topological Polar Surface Area:62.6
Heavy Atom Count:9
Complexity:110
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of [(cyclopropylmethyl)thio]aceticacid

Basic Attributes
Characteristics
Safety Information
Computed Properties

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