3-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-4-methoxybenzoic acid

HCID 10916111

Basic information

CAS
256935-69-0
Standard SMILES
COc1ccc(C(=O)O)cc1NC(=O)OCC1c2ccccc2-c2ccccc21
InChIKey
RHASRZZYFQOPAC-UHFFFAOYSA-N
Molecular formula
C23H19NO5
Average molar mass
389.4 g/mol
Monoisotopic mass
389.12632271

Names & identifiers

Preferred name
3-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-4-methoxybenzoic acid
IUPAC
3-(9H-fluoren-9-ylmethoxycarbonylamino)-4-methoxybenzoic acid
English name
3-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-4-methoxybenzoic acid
Molecular formula
C23H19NO5
Molecular weight
389.4

Names & synonyms

256935-69-03-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-4-methoxybenzoic acid3-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-4-methoxybenzoic acidRefChem:487858857-443-5Fmoc-3-amino-4-methoxybenzoic acidMFCD02682216Fmoc-3-amino-4-methoxy-benzoic acidFomc-3-amino-4-methoxybenzoic acid3-(9H-fluoren-9-ylmethoxycarbonylamino)-4-methoxybenzoic acid3-[[(9H-Fluoren-9-ylmethoxy)carbonyl]amino]-4-methoxybenzoic acidSCHEMBL7927995
Show more names
Benzoic acid, 3-[[(9H-fluoren-9-ylmethoxy)carbonyl]amino]-4-methoxy-
3-(9-fluorenylmethoxycarbonyl)amino-4-methoxybenzoic acidRHASRZZYFQOPAC-UHFFFAOYSA-N3-(9H-fluoren-9-ylmethoxycarbonylamino)-4-methoxy-benzoic Acid3-Fmoc-amino-4-methoxybenzoic acidGKA93569AKOS0130531103-(Fmoc-amino)-4-methoxybenzoic AcidSB83674

Database identifiers

CAS
256935-69-0
PubChem CID
10916111
EC Number
857-443-5

Properties

Computed structural properties

XLogP
4.1
Topological polar surface area
84.9 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
5
Rotatable bonds
6
Heavy atoms
29

Physicochemical properties

storage temp.
2 · 2-8°C
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
302 · H302-H315-H319-H335
Precautionary statements
261 · P261-P305+P351+P338

Safety & regulation

GHS classification

GHS Classification · 5 items

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral];H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation];H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation];H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Hazard information

Hazard Classes and CategoriesAcute Tox. 4 (100%);Skin Irrit. 2 (100%);Eye Irrit. 2A (100%);STOT SE 3 (100%)

Safety data

Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H302-H315-H319-H335
Precautionary statements
P261-P305+P351+P338

Chemistry & industry

Suppliers11 total

Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
毕佳索(上海毕得医药科技股份有限公司)400-6005915 · [email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
安耐吉化学&3A(安徽泽升科技有限公司)021-58432009 400-005-6266 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]

Related reactions

2 records

Compound notes

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