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(8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 2-[4-(trifluoromethyl)phenyl]prop-2-enoate;hydrate

(8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 2-[4-(trifluoromethyl)phenyl]prop-2-enoate;hydrate structure

CAS No:
64048-79-9
Formula:
C72H82F12N4O9
Chemical Name:
(8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 2-[4-(trifluoromethyl)phenyl]prop-2-enoate;hydrate
Synonyms:
3-Tropanyl 4'-(trifluoromethyl)atropate quarterhydrate;4'-(Trifluoromethyl)atropic acid, 3-tropanyl ester, quarterhydrate;ATROPIC ACID, 4'-(TRIFLUOROMETHYL)-, 3-TROPANYL ESTER, QUARTERHYDRATE;64048-79-9

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(8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 2-[4-(trifluoromethyl)phenyl]prop-2-enoate;hydrate Basic Attributes

Molecular Weight：

1375.4 g/mol

Exact Mass：

1374.5890182 g/mol

Characteristics

PSA：

119 Å²

Computed Properties

Molecular Weight:1375.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:25
Rotatable Bond Count:16
Exact Mass:1374.5890182
Monoisotopic Mass:1374.5890182
Topological Polar Surface Area:119
Heavy Atom Count:97
Complexity:483
Undefined Atom Stereocenter Count:8
Covalently-Bonded Unit Count:5
Compound Is Canonicalized:Yes

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Guide of (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 2-[4-(trifluoromethyl)phenyl]prop-2-enoate;hydrate

Basic Attributes
Characteristics
Computed Properties
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